Exact Mass: 330.0326642

Exact Mass Matches: 330.0326642

Found 500 metabolites which its exact mass value is equals to given mass value 330.0326642, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Aurantio-obtusin

1,3,7-TRIHYDROXY-2,8-DIMETHOXY-6-METHYL-9,10-DIHYDROANTHRACENE-9,10-DIONE

C17H14O7 (330.0739494)


Aurantio-obtusin is a trihydroxyanthraquinone that is 1,3,7-trihydroxy-9,10-anthraquinone which is by methoxy groups at positions 2 and 8, and by a methyl group at position 6. Aurantio-obtusin is a natural product found in Senna obtusifolia and Senna tora with data available. Aurantio-obtusin is an anthraquinone isolated from Semen Cassiae, with anti-Inflammatory, anti-oxidative, anti-coagulating and anti-hypertension activities[1][2][3]. Aurantio-obtusin relaxes systemic arteries through endothelial PI3K/AKT/eNOS-dependent signaling pathway in rats, thus acts as a new potential vasodilator[2]. Aurantio-obtusin inhibits allergic responses in IgE-mediated mast cells and anaphylactic models and is potential for treatment for allergy-related diseases[3]. Aurantio-obtusin is an anthraquinone isolated from Semen Cassiae, with anti-Inflammatory, anti-oxidative, anti-coagulating and anti-hypertension activities[1][2][3]. Aurantio-obtusin relaxes systemic arteries through endothelial PI3K/AKT/eNOS-dependent signaling pathway in rats, thus acts as a new potential vasodilator[2]. Aurantio-obtusin inhibits allergic responses in IgE-mediated mast cells and anaphylactic models and is potential for treatment for allergy-related diseases[3].

   

3,7-Dimethylquercetin

4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-5-hydroxy-3,7-dimethoxy-

C17H14O7 (330.0739494)


3,4,5-trihydroxy-3,7-dimethoxyflavone is a dimethoxyflavone that the 3,7-di-O-methyl derivative of quercetin. It has a role as an EC 1.3.1.22 [3-oxo-5alpha-steroid 4-dehydrogenase (NADP(+))] inhibitor and a metabolite. It is a trihydroxyflavone and a dimethoxyflavone. It is functionally related to a quercetin. It is a conjugate acid of a 3,4,5-trihydroxy-3,7-dimethoxyflavone(1-). 3,7-Di-O-methylquercetin is a natural product found in Wollastonia biflora, Psiadia viscosa, and other organisms with data available. 3,7-Dimethylquercetin is found in beer. 3,7-Dimethylquercetin is isolated from various plants including many Asteraceae [CCD Isolated from various plants including many Asteraceae [CCD]. 3,7-Dimethylquercetin is found in beer and grape wine. A dimethoxyflavone that the 3,7-di-O-methyl derivative of quercetin.

   

Aflatoxin G2

11-methoxy-6,8,16,20-tetraoxapentacyclo[10.8.0.0²,⁹.0³,⁷.0¹³,¹⁸]icosa-1(12),2(9),10,13(18)-tetraene-17,19-dione

C17H14O7 (330.0739494)


Aflatoxin G2 is a minor mycotoxin produced by Aspergillus flavus and Aspergillus parasiticus (Hugo Vanden Bossche, D.W.R. Mackenzie and G. Cauwenbergh. Aspergillus and Aspergillosis, 1987). D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins D009676 - Noxae > D011042 - Poisons > D000348 - Aflatoxins

   

Furosemide

4-chloro-2-{[(furan-2-yl)methyl]amino}-5-sulfamoylbenzoic acid

C12H11ClN2O5S (330.00771860000003)


Furosemide or frusemide is a loop diuretic used in the treatment of congestive heart failure and edema. It is most commonly marketed by Aventis Pharma under the brand name Lasix. It has also been used to prevent thoroughbred race horses from bleeding through the nose during races. An antibiotic isolated from the fermentation broth of Fusidium coccineum. (From Merck Index, 11th ed) It acts by inhibiting translocation during protein synthesis. Potential contaminant in cows milk arising from its use in dairy cattle for the treatment of physiological parturient edema D045283 - Natriuretic Agents > D004232 - Diuretics > D049994 - Sodium Potassium Chloride Symporter Inhibitors C - Cardiovascular system > C03 - Diuretics > C03C - High-ceiling diuretics > C03CA - Sulfonamides, plain C78275 - Agent Affecting Blood or Body Fluid > C448 - Diuretic > C49184 - Loop Diuretic D002317 - Cardiovascular Agents > D045283 - Natriuretic Agents D000890 - Anti-Infective Agents > D013424 - Sulfanilamides D049990 - Membrane Transport Modulators Furosemide is a potent and orally active inhibitor of Na+/K+/2Cl-?(NKCC) cotransporter, NKCC1 and NKCC2[1].?Furosemide is also a GABAA?receptors antagonist and displays 100-fold selectivity for?α6-containing receptors than?α1-containing receptors. Furosemide acts as a loop diuretic and used for the study of congestive heart failure, hypertension and edema[2].

   

(±)-Fenarimol

alpha-(2-Chlorophenyl)-alpha-(4-chlorophenyl)-5-pyrimidinemethanol

C17H12Cl2N2O (330.0326642)


CONFIDENCE standard compound; INTERNAL_ID 1087; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9386; ORIGINAL_PRECURSOR_SCAN_NO 9383 CONFIDENCE standard compound; INTERNAL_ID 1087; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4478; ORIGINAL_PRECURSOR_SCAN_NO 4475 CONFIDENCE standard compound; INTERNAL_ID 1087; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9454; ORIGINAL_PRECURSOR_SCAN_NO 9451 CONFIDENCE standard compound; INTERNAL_ID 1087; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4990; ORIGINAL_PRECURSOR_SCAN_NO 4987 CONFIDENCE standard compound; INTERNAL_ID 1087; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4961; ORIGINAL_PRECURSOR_SCAN_NO 4959 CONFIDENCE standard compound; INTERNAL_ID 1087; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4563; ORIGINAL_PRECURSOR_SCAN_NO 4561 CONFIDENCE standard compound; INTERNAL_ID 1087; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9431; ORIGINAL_PRECURSOR_SCAN_NO 9426 CONFIDENCE standard compound; INTERNAL_ID 1087; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4978; ORIGINAL_PRECURSOR_SCAN_NO 4977 CONFIDENCE standard compound; INTERNAL_ID 1087; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9464; ORIGINAL_PRECURSOR_SCAN_NO 9462 CONFIDENCE standard compound; INTERNAL_ID 1087; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9492; ORIGINAL_PRECURSOR_SCAN_NO 9490 CONFIDENCE standard compound; INTERNAL_ID 1087; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9499; ORIGINAL_PRECURSOR_SCAN_NO 9498 (±)-Fenarimol is an Agricultural and horticultural fungicide. Agricultural and horticultural fungicide D016573 - Agrochemicals D010575 - Pesticides

   

Malathion

1,4-diethyl 2-{[dimethoxy(sulfanylidene)-lambda5-phosphanyl]sulfanyl}butanedioate

C10H19O6PS2 (330.0360644)


Malathion is only found in individuals that have used or taken this drug. It is a wide spectrum aliphatic organophosphate insecticide widely used for both domestic and commercial agricultural purposes. [PubChem]Malathion is a nonsystemic, wide-spectrum organophosphate insecticide. It inhibits acetylcholinesterase activity of most eukaryotes. Malathion is toxic to aquatic organisms, but has a relatively low toxicity for birds and mammals. The major metabolites of malathion are mono- and di-carboxylic acid derivatives, and malaoxon is a minor metabolite. However, it is malaoxon that is the strongest cholinesterase inhibitor. Cholinesterases catalyze the hydrolysis of the neurotransmitter acetylcholine into choline and acetic acid, a reaction necessary to allow a cholinergic neuron to return to its resting state after activation. Because of its essential function, chemicals that interfere with the action of cholinesterase are potent neurotoxins, causing muscle spasms and ultimately death. P - Antiparasitic products, insecticides and repellents > P03 - Ectoparasiticides, incl. scabicides, insecticides and repellents > P03A - Ectoparasiticides, incl. scabicides D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors D010575 - Pesticides > D007306 - Insecticides D004791 - Enzyme Inhibitors D016573 - Agrochemicals

   

Tricin

5,7-Dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


[Raw Data] CBA24_Tricin_neg_50eV_1-6_01_1424.txt [Raw Data] CBA24_Tricin_pos_50eV_1-6_01_1397.txt [Raw Data] CBA24_Tricin_neg_10eV_1-6_01_1368.txt [Raw Data] CBA24_Tricin_pos_40eV_1-6_01_1396.txt [Raw Data] CBA24_Tricin_pos_20eV_1-6_01_1394.txt [Raw Data] CBA24_Tricin_neg_30eV_1-6_01_1422.txt [Raw Data] CBA24_Tricin_neg_20eV_1-6_01_1421.txt [Raw Data] CBA24_Tricin_pos_10eV_1-6_01_1357.txt [Raw Data] CBA24_Tricin_pos_30eV_1-6_01_1488.txt [Raw Data] CBA24_Tricin_neg_40eV_1-6_01_1423.txt Tricin is a natural flavonoid present in large amounts in Triticum aestivum. Tricin can inhibit human cytomegalovirus (HCMV) replication by inhibiting CDK9. Tricin inhibits the proliferation and invasion of C6 glioma cells via the upregulation of focal-adhesion-finase (FAK)-targeting microRNA-7[1][2][3]. Tricin is a natural flavonoid present in large amounts in Triticum aestivum. Tricin can inhibit human cytomegalovirus (HCMV) replication by inhibiting CDK9. Tricin inhibits the proliferation and invasion of C6 glioma cells via the upregulation of focal-adhesion-finase (FAK)-targeting microRNA-7[1][2][3].

   

Pyrroloquinoline quinone

4,5-Dihydro-4,5-dioxo-1H-pyrrolo[2,3-5,6]quinoline-2,7,9-tricarboxylic acid

C14H6N2O8 (330.0124156)


Enzymes containing PQQ are called quinoproteins. PQQ and quinoproteins play a role in the redox metabolism and structural integrity of cells and tissues [PMID:2558842]. It was reported that aminoadipate semialdehyde dehydrogenase (AASDH) might also use PQQ as a cofactor, suggesting a possibility that PQQ is a vitamin in mammals. [PMID:12712191]. Believed to be a mammalian redox-cofactor vitamin (B group). Widely distributed in various foods such as vegetables and meat. Methoxatin is found in animal foods and green vegetables. Pyrroloquinoline quinone (PQQ), a redox co-factor, is an anionic, redox-cycling orthoquinone. Pyrroloquinoline quinone is isolated from cultures of methylotropic bacteria and tissues of mammals. Pyrroloquinoline quinone is an essential nutrient for mammals and is important for immune function[1][2].

   

3,5-Cyclic IMP

3,5-Cyclic Inosine monophosphate (cIMP)

C10H11N4O7P (330.03653460000004)


A 3,5-cyclic purine nucleotide having hypoxanthine as the nucleobase.

   

Bisdechlorogeodin

(+)-Bisdechlorogeodin

C17H14O7 (330.0739494)


   

Cirsiliol

2-(3,4-dihydroxyphenyl)-5-hydroxy-6,7-dimethoxy-4H-chromen-4-one

C17H14O7 (330.0739494)


Cirsiliol, also known as 3,4,5-trihydroxy-6,7-dimethoxyflavone or 6,7-dimethoxy-5,3,4-trihydroxyflavone, is a member of the class of compounds known as 7-o-methylated flavonoids. 7-o-methylated flavonoids are flavonoids with methoxy groups attached to the C7 atom of the flavonoid backbone. Thus, cirsiliol is considered to be a flavonoid lipid molecule. Cirsiliol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Cirsiliol can be found in common sage and lemon verbena, which makes cirsiliol a potential biomarker for the consumption of these food products. Cirsiliol is a potent and selective 5-lipoxygenase inhibitor and a competitive low affinity benzodiazepine receptor ligand. Cirsiliol is a potent and selective 5-lipoxygenase inhibitor and a competitive low affinity benzodiazepine receptor ligand. Cirsiliol is a potent and selective 5-lipoxygenase inhibitor and a competitive low affinity benzodiazepine receptor ligand.

   

Hildecarpin

3,6a-Dihydroxy-2-methoxy-8,9-methylenedioxypterocarpan

C17H14O7 (330.0739494)


   

N-(3-(Trifluoromethyl)phenyl)-N'-(2-hydroxy-5-chlorophenyl)urea

1-(5-chloro-2-hydroxyphenyl)-3-[3-(trifluoromethyl)phenyl]urea

C14H10ClF3N2O2 (330.0382866)


   

Monohydroxymethoxychlor

1,1,1-Trichloro-2-(4-hydroxyphenyl)-2-(4-methoxyphenyl)ethane

C15H13Cl3O2 (329.9981088)


   
   
   

Aluminium acetoacetate

Aluminium acetoacetate

C12H15AlO9 (330.053145)


A - Alimentary tract and metabolism > A02 - Drugs for acid related disorders > A02A - Antacids > A02AB - Aluminium compounds

   

(-)-Bisdechlorogeodin

(-)-Bisdechlorogeodin

C17H14O7 (330.0739494)


   

almecillin

Penicillin O

C13H18N2O4S2 (330.0707948)


A penicillin where the side-chain N-acyl group is specified as allylmercaptoacetyl. Antibiotic isolated from Penicillium chrysogenum. C254 - Anti-Infective Agent > C258 - Antibiotic > C260 - Beta-Lactam Antibiotic

   

Caryatin

2-(3,4-Dihydroxyphenyl)-7-hydroxy-3,5-dimethoxy-4H-1-benzopyran-4-one, 9CI

C17H14O7 (330.0739494)


Caryatin is a member of flavonoids and an ether. Caryatin is a natural product found in Aeonium decorum, Aeonium lindleyi, and other organisms with data available. Isolated from pecan nuts Carya pecan. 3,5-Dimethylquercetin is found in pecan nut and nuts. Caryatin is found in nuts. Caryatin is isolated from pecan nuts Carya pecan.

   

Prudomestin

3,5,7-Trihydroxy-8-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


Prudomestin is a hydroxyflavan. Prudomestin is a natural product found in Zanthoxylum acanthopodium and Prunus domestica with data available. Prudomestin is found in european plum. Prudomestin is isolated from heartwood of Prunus domestica (plum Isolated from heartwood of Prunus domestica (plum). Prudomestin is found in fruits and european plum. Prudomestin, isolated from the heartwood of Prunus domestica, shows potent xanthine oxidase (XO) inhibitory activity (IC50≈6?μM)[1][2].

   

Aflatoxin M2

(3R,7R)-3-hydroxy-11-methoxy-6,8,19-trioxapentacyclo[10.7.0.0²,⁹.0³,⁷.0¹³,¹⁷]nonadeca-1,9,11,13(17)-tetraene-16,18-dione

C17H14O7 (330.0739494)


Trace mycotoxin of Aspergillus flavus [CCD].Aflatoxins are naturally occurring mycotoxins that are produced by many species of Aspergillus, a fungus, most notably Aspergillus flavus and Aspergillus parasiticus. Aflatoxins are toxic and among the most carcinogenic substances known. Aflatoxin M2 is a metabolite of aflatoxin B2 in milk of cattle fed on contaminated foods. (Wikipedia) D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins D009676 - Noxae > D011042 - Poisons > D000348 - Aflatoxins

   

Trifolian

15-methoxy-5,7,11,19-tetraoxapentacyclo[10.8.0.0²,¹⁰.0⁴,⁸.0¹³,¹⁸]icosa-2,4(8),9,13(18),14,16-hexaene-14,16-diol

C17H14O7 (330.0739494)


Trifolian is found in herbs and spices. Trifolian is isolated from roots of Trifolium pratense (red clover). Isolated from roots of Trifolium pratense (red clover). Trifolian is found in tea and herbs and spices.

   

3',4'-Di-O-methylquercetin

2-(3,4-Dimethoxyphenyl)-3,5,7-trihydroxy-4H-1-benzopyran-4-one, 9ci

C17H14O7 (330.0739494)


3,4-Di-O-methylquercetin is found in beverages. 3,4-Di-O-methylquercetin is isolated from Dillenia indica (elephant apple). Isolated from Dillenia indica (elephant apple). 3,4-Dimethylquercetin is found in beverages and fruits.

   
   

Demethoxysudachitin

5,7-Dihydroxy-2-(4-hydroxyphenyl)-6,8-dimethoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


Demethoxysudachitin is found in citrus. Demethoxysudachitin is isolated from Citrus sudachi and Mentha piperit

   

Pilosin

5,7,8-trihydroxy-6-methoxy-2-(4-methoxyphenyl)-4H-chromen-4-one

C17H14O7 (330.0739494)


Pilosin is found in herbs and spices. Pilosin is a constituent of Ocimum americanum var. pilosum and Ocimum x citriodorum (lemon basil). Constituent of Ocimum americanum variety pilosum and Ocimum x citriodorum (lemon basil). Pilosin is found in herbs and spices. Jaceosidin is a flavonoid isolated from Artemisia vestita, induces apoptosis in cancer cells, activates Bax and down-regulates Mcl-1 and c-FLIP expression[1]. Jaceosidin exhibits anti-cancer[2], anti-inflammatory activities, decreases leves of inflammatory markers, and suppresses COX-2 expression and NF-κB activation[3]. Jaceosidin is a flavonoid isolated from Artemisia vestita, induces apoptosis in cancer cells, activates Bax and down-regulates Mcl-1 and c-FLIP expression[1]. Jaceosidin exhibits anti-cancer[2], anti-inflammatory activities, decreases leves of inflammatory markers, and suppresses COX-2 expression and NF-κB activation[3].

   

1,3,5-Trihydroxy-6,7-dimethoxy-2-methylanthraquinone

1,3,5-trihydroxy-6,7-dimethoxy-2-methyl-9,10-dihydroanthracene-9,10-dione

C17H14O7 (330.0739494)


1,3,5-Trihydroxy-6,7-dimethoxy-2-methylanthraquinone is found in coffee and coffee products. 1,3,5-Trihydroxy-6,7-dimethoxy-2-methylanthraquinone is isolated from roots of Cassia tora (charota). Isolated from roots of Cassia tora (charota). 1,3,5-Trihydroxy-6,7-dimethoxy-2-methylanthraquinone is found in coffee and coffee products, herbs and spices, and pulses.

   

Cicerin

5,7-dihydroxy-3-(6-methoxy-2H-1,3-benzodioxol-5-yl)-3,4-dihydro-2H-1-benzopyran-4-one

C17H14O7 (330.0739494)


Cicerin is found in pulses. Cicerin is a constituent of Cicer arietinum (chickpea). Constituent of Cicer arietinum (chickpea). Cicerin is found in pulses.

   

5,6,4-Trihydroxy-7,3-dimethoxyflavone

5,6,4-Trihydroxy-7,3-dimethoxyflavone

C17H14O7 (330.0739494)


   

Aflatoxin B2a

5-hydroxy-11-methoxy-6,8,19-trioxapentacyclo[10.7.0.0²,⁹.0³,⁷.0¹³,¹⁷]nonadeca-1(12),2(9),10,13(17)-tetraene-16,18-dione

C17H14O7 (330.0739494)


Aflatoxin B2a is a metabolite of Aspergillus flavus and Aspergillus parasiticus (Hugo Vanden Bossche, D.W.R. Mackenzie and G. Cauwenbergh. Aspergillus and Aspergillosis, 1987). Metabolite of Aspergillus flavus

   

3,5,7-Trihydroxy-6,8-dimethoxyflavone

3,5,7-Trihydroxy-6,8-dimethoxyflavone

C17H14O7 (330.0739494)


   

2,3-Di-O-methylellagic acid

6,7-dihydroxy-13,14-dimethoxy-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione

C16H10O8 (330.037566)


2,3-Di-O-methylellagic acid is found in fats and oils. 2,3-Di-O-methylellagic acid is a constituent of the Chinese tallowtree (Sapium sebiferum). Constituent of the Chinese tallowtree (Sapium sebiferum). 2,3-Dimethylellagic acid is found in fats and oils.

   

3,4-Dihydroxyphenacyl caffeate

2-(3,4-Dihydroxyphenyl)-2-oxoethyl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid

C17H14O7 (330.0739494)


3,4-Dihydroxyphenacyl caffeate is found in green vegetables. 3,4-Dihydroxyphenacyl caffeate is a constituent of the rhizomes of Petasites japonicus (sweet coltsfoot)

   

Apometzgerin

4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-

C17H14O7 (330.0739494)


   

Inosine 2',3'-cyclic phosphate

9-[(3aR,4R,6R,6aR)-2-hydroxy-6-(hydroxymethyl)-2-oxo-tetrahydro-2H-2λ⁵-furo[3,4-d][1,3,2]dioxaphosphol-4-yl]-6,9-dihydro-3H-purin-6-one

C10H11N4O7P (330.03653460000004)


Inosine-2′,3′-cyclic phosphate is a cyclic nucleotide. A cyclic nucleotide is any nucleotide in which the phosphate group is bonded to two of the sugars hydroxyl groups, forming a cyclical or ring structure. 2,3 cyclic IMP is a substrate for 2,3-cyclic-nucleotide 3-phosphodiesterase (EC 3.1.4.37). This enzyme (also called CNP) catalyzes the chemical reaction: nucleoside 2,3-cyclic phosphate + H2O <-> nucleoside 2-phosphate. CNP is a myelin-associated enzyme that makes up 4\\% of total CNS myelin protein, and is thought to undergo significant age-associated changes. The absence of CNP causes axonal swelling and neuronal degeneration. The biological role of cyclic 2,3 monophosphates is not clear, although it is thought to have something to do with neuronal stasis or development.

   

Blighinone

1,4,9-trihydroxy-9-methyl-5,8,10-trioxo-5,8,9,10-tetrahydrophenanthrene-2-carboxylic acid

C16H10O8 (330.037566)


Blighinone is found in fruits. Quinone from the fruit pulp of Blighia sapida (akee apple

   

2,8-Di-O-methylellagic acid

6,14-dihydroxy-7,13-dimethoxy-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione

C16H10O8 (330.037566)


2,8-Di-O-methylellagic acid is found in fruits. 2,8-Di-O-methylellagic acid is a constituent of the Java plum (Eugenia jambolana). Constituent of the Java plum (Eugenia jambolana). 2,8-Dimethylellagic acid is found in fruits.

   

5,7-Dihydroxy-8,4'-dimethoxyisoflavone

5,7-dihydroxy-3-(2-hydroxy-4-methoxyphenyl)-8-methoxy-4H-chromen-4-one

C17H14O7 (330.0739494)


5,7-Dihydroxy-8,4-dimethoxyisoflavone is a polyphenol metabolite detected in biological fluids (PMID: 20428313). A polyphenol metabolite detected in biological fluids [PhenolExplorer]

   

5-Hydroxydantrolene

4,5-dihydroxy-1-[(E)-{[5-(4-nitrophenyl)furan-2-yl]methylidene}amino]-2,5-dihydro-1H-imidazol-2-one

C14H10N4O6 (330.060032)


5-Hydroxydantrolene is a metabolite of dantrolene. Dantrolene sodium is a muscle relaxant that acts by abolishing excitation-contraction coupling in muscle cells, probably by action on the ryanodine receptor. It is the only specific and effective treatment for malignant hyperthermia, a rare, life-threatening disorder triggered by general anesthesia. (Wikipedia)

   

6-(4-carboxy-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

6-(4-carboxy-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C13H14O10 (330.05869440000004)


6-(4-carboxy-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid is a predicted metabolite generated by BioTransformer¹ that is produced by the metabolism of 3,4-dihydroxybenzoic acid. It is generated by UDP-glucuronosyltransferase 1-1 (P22309) enzyme via an aromatic-OH-glucuronidation reaction. This aromatic-OH-glucuronidation occurs in humans.

   

6-(5-carboxy-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

6-(5-carboxy-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C13H14O10 (330.05869440000004)


6-(5-carboxy-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid is a predicted metabolite generated by BioTransformer¹ that is produced by the metabolism of 3,4-dihydroxybenzoic acid. It is generated by UDP-glucuronosyltransferase 1-1 (P22309) enzyme via an aromatic-OH-glucuronidation reaction. This aromatic-OH-glucuronidation occurs in humans.

   

6-(4-carboxy-3-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

6-(4-carboxy-3-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C13H14O10 (330.05869440000004)


6-(4-carboxy-3-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid is a predicted metabolite generated by BioTransformer¹ that is produced by the metabolism of 2,4-dihydroxybenzoic acid. It is generated by UDP-glucuronosyltransferase 1-1 (P22309) enzyme via an aromatic-OH-glucuronidation reaction. This aromatic-OH-glucuronidation occurs in humans.

   

6-(2-carboxy-5-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

6-(2-carboxy-5-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C13H14O10 (330.05869440000004)


6-(2-carboxy-5-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid is a predicted metabolite generated by BioTransformer¹ that is produced by the metabolism of 2,4-dihydroxybenzoic acid. It is generated by UDP-glucuronosyltransferase 1-1 (P22309) enzyme via an aromatic-OH-glucuronidation reaction. This aromatic-OH-glucuronidation occurs in humans.

   

6-(3-carboxy-5-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

6-(3-carboxy-5-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C13H14O10 (330.05869440000004)


6-(3-carboxy-5-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid is a predicted metabolite generated by BioTransformer¹ that is produced by the metabolism of 3,5-dihydroxybenzoic acid. It is generated by UDP-glucuronosyltransferase 1-1 (P22309) enzyme via an aromatic-OH-glucuronidation reaction. This aromatic-OH-glucuronidation occurs in humans.

   

6-(3-carboxy-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

6-(3-carboxy-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C13H14O10 (330.05869440000004)


6-(3-carboxy-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid is a predicted metabolite generated by BioTransformer¹ that is produced by the metabolism of 2,3-dihydroxybenzoic acid. It is generated by UDP-glucuronosyltransferase 1-1 (P22309) enzyme via an aromatic-OH-glucuronidation reaction. This aromatic-OH-glucuronidation occurs in humans.

   

6-(2-carboxy-6-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

6-(2-carboxy-6-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C13H14O10 (330.05869440000004)


6-(2-carboxy-6-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid is a predicted metabolite generated by BioTransformer¹ that is produced by the metabolism of 2,3-dihydroxybenzoic acid. It is generated by UDP-glucuronosyltransferase 1-1 (P22309) enzyme via an aromatic-OH-glucuronidation reaction. This aromatic-OH-glucuronidation occurs in humans.

   

6-(3-carboxy-4-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

6-(3-carboxy-4-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C13H14O10 (330.05869440000004)


6-(3-carboxy-4-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid is a predicted metabolite generated by BioTransformer¹ that is produced by the metabolism of 2,5-dihydroxybenzoic acid. It is generated by UDP-glucuronosyltransferase 1-1 (P22309) enzyme via an aromatic-OH-glucuronidation reaction. This aromatic-OH-glucuronidation occurs in humans.

   

6-(2-carboxy-4-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

6-(2-carboxy-4-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C13H14O10 (330.05869440000004)


6-(2-carboxy-4-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid is a predicted metabolite generated by BioTransformer¹ that is produced by the metabolism of 2,5-dihydroxybenzoic acid. It is generated by UDP-glucuronosyltransferase 1-1 (P22309) enzyme via an aromatic-OH-glucuronidation reaction. This aromatic-OH-glucuronidation occurs in humans.

   

(2r)-(4-Chlorophenyl)[3-(Trifluoromethyl)phenoxy]ethanoic Acid

(2r)-(4-Chlorophenyl)[3-(Trifluoromethyl)phenoxy]ethanoic Acid

C15H10ClF3O3 (330.02705360000004)


   

5-Hydroxy Dantrolene

5-hydroxy-1-({[5-(4-nitrophenyl)furan-2-yl]methylidene}amino)imidazolidine-2,4-dione

C14H10N4O6 (330.060032)


   

Almecillin

6-{[1-hydroxy-2-(prop-2-en-1-ylsulphanyl)ethylidene]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

C13H18N2O4S2 (330.0707948)


   

Mivotilate

propan-2-yl 2-(1,3-dithietan-2-ylidene)-2-[(4-methyl-1,3-thiazol-2-yl)carbamoyl]acetate

C12H14N2O3S3 (330.0166534)


C26170 - Protective Agent > C2081 - Hepatoprotective Agent

   

Pirazolac

2-[4-(4-chlorophenyl)-1-(4-fluorophenyl)-1H-pyrazol-3-yl]acetic acid

C17H12ClFN2O2 (330.05712939999995)


   

6-Hydroxykaempferol 3,6-dimethylether

5,7-dihydroxy-2-(4-hydroxyphenyl)-3,6-dimethoxy-4H-chromen-4-one

C17H14O7 (330.0739494)


6-hydroxykaempferol 3,6-dimethylether, also known as 4,5,7-trihydroxy-3,6-dimethoxyflavone, is a member of the class of compounds known as 6-o-methylated flavonoids. 6-o-methylated flavonoids are flavonoids with methoxy groups attached to the C6 atom of the flavonoid backbone. Thus, 6-hydroxykaempferol 3,6-dimethylether is considered to be a flavonoid lipid molecule. 6-hydroxykaempferol 3,6-dimethylether is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 6-hydroxykaempferol 3,6-dimethylether can be found in sweet cherry, which makes 6-hydroxykaempferol 3,6-dimethylether a potential biomarker for the consumption of this food product.

   

Frusemide

furosemide

C12H11ClN2O5S (330.00771860000003)


D045283 - Natriuretic Agents > D004232 - Diuretics > D049994 - Sodium Potassium Chloride Symporter Inhibitors C - Cardiovascular system > C03 - Diuretics > C03C - High-ceiling diuretics > C03CA - Sulfonamides, plain C78275 - Agent Affecting Blood or Body Fluid > C448 - Diuretic > C49184 - Loop Diuretic D002317 - Cardiovascular Agents > D045283 - Natriuretic Agents D000890 - Anti-Infective Agents > D013424 - Sulfanilamides CONFIDENCE standard compound; EAWAG_UCHEM_ID 2600 D049990 - Membrane Transport Modulators Furosemide is a potent and orally active inhibitor of Na+/K+/2Cl-?(NKCC) cotransporter, NKCC1 and NKCC2[1].?Furosemide is also a GABAA?receptors antagonist and displays 100-fold selectivity for?α6-containing receptors than?α1-containing receptors. Furosemide acts as a loop diuretic and used for the study of congestive heart failure, hypertension and edema[2].

   

Oprea1_264874

6,13-dihydroxy-7,14-dimethoxy-2,9-dioxatetracyclo[6.6.2.0^{4,16.0^{11,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione

C16H10O8 (330.037566)


3,3-Di-O-methylellagic acid is a natural product found in Kunzea ambigua, Lagerstroemia speciosa, and other organisms with data available.

   

5U4Y68G678

4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-methoxy-

C17H14O7 (330.0739494)


Jaceosidin is a trihydroxyflavone that is flavone with hydroxy groups at positions 5, 7 and 4 and methoxy groups at positions 3 and 6. Isolated from Salvia tomentosa and Artemisia asiatica, it exhibits anti-allergic, anti-inflammatory and apoptosis inducing activties. It has a role as a metabolite, an anti-inflammatory agent, an apoptosis inducer, an anti-allergic agent and an antineoplastic agent. It is a trihydroxyflavone and a dimethoxyflavone. Jaceosidin is a natural product found in Eupatorium capillifolium, Eupatorium leucolepis, and other organisms with data available. A trihydroxyflavone that is flavone with hydroxy groups at positions 5, 7 and 4 and methoxy groups at positions 3 and 6. Isolated from Salvia tomentosa and Artemisia asiatica, it exhibits anti-allergic, anti-inflammatory and apoptosis inducing activties. Jaceosidin is a flavonoid isolated from Artemisia vestita, induces apoptosis in cancer cells, activates Bax and down-regulates Mcl-1 and c-FLIP expression[1]. Jaceosidin exhibits anti-cancer[2], anti-inflammatory activities, decreases leves of inflammatory markers, and suppresses COX-2 expression and NF-κB activation[3]. Jaceosidin is a flavonoid isolated from Artemisia vestita, induces apoptosis in cancer cells, activates Bax and down-regulates Mcl-1 and c-FLIP expression[1]. Jaceosidin exhibits anti-cancer[2], anti-inflammatory activities, decreases leves of inflammatory markers, and suppresses COX-2 expression and NF-κB activation[3].

   

Iristectorigenin

4H-1-Benzopyran-4-one, 5,7-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-6-methoxy-

C17H14O7 (330.0739494)


Iristectorigenin B is a natural product found in Iris japonica, Sophora tomentosa, and other organisms with data available. Iristectorigenin B (Iristectrigenin B) is a liver X receptor (LXR) modulator. Iristectrigenin B stimulates the transcriptional activity of both LXR-α and LXR-β[1]. Iristectorigenin B (Iristectrigenin B) is a liver X receptor (LXR) modulator. Iristectrigenin B stimulates the transcriptional activity of both LXR-α and LXR-β[1]. Iristectorigenin B (Iristectrigenin B) is a liver X receptor (LXR) modulator. Iristectrigenin B stimulates the transcriptional activity of both LXR-α and LXR-β[1].

   
   

(+)-Hydroxypisatin

(6aR,11aR)2,6a-Dihydroxy-3-methoxy-8,9-methylenedioxypterocarpan

C17H14O7 (330.0739494)


   
   

(-)-4,11,12a-Trihydroxy-9-methoxyrotenone

(-)-4,11,12a-Trihydroxy-9-methoxyrotenone

C17H14O7 (330.0739494)


   

5,8,3-Trihydroxy-7,2-dimethoxyisoflavone

5,8,3-Trihydroxy-7,2-dimethoxyisoflavone

C17H14O7 (330.0739494)


   

Andinermal C

3-Carboxyaldehyde-4,3,4-trihydroxy-6,2-dimethoxy-2-arylbenzofuran

C17H14O7 (330.0739494)


   
   

5-Methoxypeltogynone

(6aR,12aR) -2,3,10-Trihydroxy-8-methoxy-6,12-dioxabenz (a) anthracen-7 (5H,6aH,12aH) -one

C17H14O7 (330.0739494)


   

Aromadendrin 3-acetate

Aromadendrin 3-acetate

C17H14O7 (330.0739494)


   
   

6,7,3-Trihydroxy-5,2-dimethoxyisoflavone

6,7,3-Trihydroxy-5,2-dimethoxyisoflavone

C17H14O7 (330.0739494)


   

5,6,4-Trihydroxy-7,3-dimethoxyIsoflavone

5,6,4-Trihydroxy-7,3-dimethoxyIsoflavone

C17H14O7 (330.0739494)


   

7,8,3-Trihydroxy-6,4-dimethoxyisoflavone

7,8,3-Trihydroxy-6,4-dimethoxyisoflavone

C17H14O7 (330.0739494)


   

3,3-Dimethoxyellagic acid

3,3-Di-O-methylellagic acid

C16H10O8 (330.037566)


   
   
   

Tephrocarpin

3,6a-Dihydroxy-4-methoxy-8,9-methylenedioxypterocarpan

C17H14O7 (330.0739494)


   
   

5,7,4-Trihydroxy-6,8-dimethoxyisoflavone

5,7,4-Trihydroxy-6,8-dimethoxyisoflavone

C17H14O7 (330.0739494)


   

5,6,3-Trihydroxy-7,2-dimethoxyisoflavone

5,6,3-Trihydroxy-7,2-dimethoxyisoflavone

C17H14O7 (330.0739494)


   

9-demethyl FR-901235

(+)-9-Demethyl FR-901235

C17H14O7 (330.0739494)


   
   

Remerin[alkaloid]

Remerin[alkaloid]

C17H14O7 (330.0739494)


   

5-Methoxymopanone

(6aR,12aR) -3,4,10-Trihydroxy-8-methoxy-6,12-dioxabenz (a) anthracen-7 (5H,6aH,12aH) -one

C17H14O7 (330.0739494)


   
   
   

3-acetoxy-5,7,4-trihydroxyflavanone

(-)-cis-3-Acetoxy-5,7,4-trihydroxyflavanone

C17H14O7 (330.0739494)


   

4,4-Di-O-methylellagic acid

4,4-Di-O-methylellagic acid

C16H10O8 (330.037566)


   
   

Thymusin

5,6-Dihydroxy-2- (4-hydroxyphenyl) -7,8-dimethoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

Demethoxycentaureidin

5,7-Dihydroxy-2- (3-hydroxy-4-methoxyphenyl) -6-methoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

6-Hydroxyluteolin 7,3-dimethyl ether

5,6-Dihydroxy-2- (4-hydroxy-3-methoxyphenyl) -7-methoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

Nuchensin

5,6-Dihydroxy-2- (3-hydroxy-4-methoxyphenyl) -7-methoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

Hypolaetin 8,3-dimethyl ether

5,7-Dihydroxy-2- (4-hydroxy-3-methoxyphenyl) -8-methoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

Apometzgerin

4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-

C17H14O7 (330.0739494)


   

3,5,7-Trihydroxy-6,8-dimethoxyflavone

3,5,7-Trihydroxy-6,8-dimethoxy-2-phenyl-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

6-Hydroxykaempferol 3,6-dimethylether

5,7-Dihydroxy-2- (4-hydroxyphenyl) -3,6-dimethoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


6-hydroxykaempferol 3,6-dimethylether, also known as 4,5,7-trihydroxy-3,6-dimethoxyflavone, is a member of the class of compounds known as 6-o-methylated flavonoids. 6-o-methylated flavonoids are flavonoids with methoxy groups attached to the C6 atom of the flavonoid backbone. Thus, 6-hydroxykaempferol 3,6-dimethylether is considered to be a flavonoid lipid molecule. 6-hydroxykaempferol 3,6-dimethylether is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 6-hydroxykaempferol 3,6-dimethylether can be found in sweet cherry, which makes 6-hydroxykaempferol 3,6-dimethylether a potential biomarker for the consumption of this food product.

   

6-Hydroxykaempferol 3,7-dimethyl ether

5,6-Dihydroxy-2-(4-hydroxyphenyl)-3,7-dimethoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

6-Hydroxykaempferol 5,6-dimethyl ether

3,7-Dihydroxy-2- (4-hydroxyphenyl) -5,6-dimethoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

betuletol

3,5-Dihydroxy-2- (4-hydroxyphenyl) -6,7-dimethoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

3,5,6-Trihydroxy-7,4-dimethoxyflavone

3,5,6-Trihydroxy-7-methoxy-2- (4-methoxyphenyl) -4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

3,7-Dimethylherbacetin

5,8-Dihydroxy-2- (4-hydroxyphenyl) -3,7-dimethoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

3,8-Dimethylherbacetin

5,7-Dihydroxy-2- (4-hydroxyphenyl) -3,8-dimethoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

Herbacetin 7,8-dimethyl ether

3,5-Dihydroxy-2- (4-hydroxyphenyl) -7,8-dimethoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

3,5,2-Trihydroxy-7,5-dimethoxyflavone

3,5-Dihydroxy-2- (2-hydroxy-5-methoxyphenyl) -7-methoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

3,3-Dimethylquercetin

5,7-Dihydroxy-2- (4-hydroxy-3-methoxyphenyl) -3-methoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

Quercetin 3,4-dimethyl ether

5,7-Dihydroxy-2- (3-hydroxy-4-methoxyphenyl) -3-methoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


A dimethoxyflavone that is the 3,4-dimethyl ether derivative of quercetin. Isolated from Combretum quadrangulare, it exhibits antineoplastic activity.

   

Quercetin 5,3-dimethyl ether

3,7-Dihydroxy-2- (4-hydroxy-3-methoxyphenyl) -5-methoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

Rhamnazin

4H-1-Benzopyran-4-one, 3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-

C17H14O7 (330.0739494)


Rhamnacene is a dimethoxyflavone that is quercetin in which the hydroxy groups at the 3 and 7 positions have been replaced by methoxy groups. It has a role as a plant metabolite and an antineoplastic agent. It is a dimethoxyflavone, a trihydroxyflavone, an aromatic ether and a member of phenols. It is functionally related to a quercetin. It is a conjugate acid of a rhamnacene-3-olate. Rhamnazin is a natural product found in Ammi visnaga, Nymphoides indica, and other organisms with data available. A dimethoxyflavone that is quercetin in which the hydroxy groups at the 3 and 7 positions have been replaced by methoxy groups. Rhamnazin, also known as 3,7-dimethylquercetin or 3,5,4-trihydroxy-7,3-dimethoxyflavone, is a member of the class of compounds known as flavonols. Flavonols are compounds that contain a flavone (2-phenyl-1-benzopyran-4-one) backbone carrying a hydroxyl group at the 3-position. Thus, rhamnazin is considered to be a flavonoid lipid molecule. Rhamnazin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Rhamnazin can be synthesized from quercetin. Rhamnazin can also be synthesized into viscumneoside VII and viscumneoside IV. Rhamnazin can be found in lemon balm, which makes rhamnazin a potential biomarker for the consumption of this food product. Rhamnazin is an O-methylated flavonol, a type of chemical compound. It can be found in Rhamnus petiolaris, a buckthorn plant endemic to Sri Lanka .

   

Ombuin

4H-1-Benzopyran-4-one, 3,5-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-methoxy-

C17H14O7 (330.0739494)


Ombuin is a dimethoxyflavone that is quercetin in which the hydroxy groups at positions 7 and 4 are replaced by methoxy groups. Isolated from Cyperus teneriffae, it exhibits anti-inflammatory activity. It has a role as an anti-inflammatory agent and a plant metabolite. It is a trihydroxyflavone, a member of flavonols and a dimethoxyflavone. It is functionally related to a quercetin. It is a conjugate acid of a 7,4-O-dimethylquercetin 3-olate. Ombuin is a natural product found in Chromolaena odorata, Clausena dunniana, and other organisms with data available. A dimethoxyflavone that is quercetin in which the hydroxy groups at positions 7 and 4 are replaced by methoxy groups. Isolated from Cyperus teneriffae, it exhibits anti-inflammatory activity. Ombuin, isolated from Zanthoxylum armatum, displays broad spectrum antibacterial effect with MIC ranges from 125 to 500 μg/mL[1]. Ombuin, isolated from Zanthoxylum armatum, displays broad spectrum antibacterial effect with MIC ranges from 125 to 500 μg/mL[1].

   

7,8,4-Trihydroxy-3,3-dimethoxyflavone

7,8-Dihydroxy-2- (4-hydroxy-3-methoxyphenyl) -3-methoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

5,7,2-Trihydroxy-6,8-dimethoxyflavone

5,7-Dihydroxy-2- (2-hydroxyphenyl) -6,8-dimethoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

Isothymusin

5,8-Dihydroxy-2-(4-hydroxyphenyl)-6,7-dimethoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


Isothymusin, also known as 6,7-dimethoxy-5,8,4-trihydroxyflavone, is a member of the class of compounds known as 7-o-methylated flavonoids. 7-o-methylated flavonoids are flavonoids with methoxy groups attached to the C7 atom of the flavonoid backbone. Thus, isothymusin is considered to be a flavonoid lipid molecule. Isothymusin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Isothymusin can be found in sour cherry, which makes isothymusin a potential biomarker for the consumption of this food product. Isothymusin is a natural product found in Prunus cerasus, Ocimum americanum, and other organisms with data available.

   

5,6,7-Trihydroxy-8,4-dimethoxyflavone

5,6,7-Trihydroxy-8-methoxy-2- (4-methoxyphenyl) -4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

5,4,5-Trihydroxy-6,2-dimethoxyflavone

2- (4,5-Dihydroxy-2-methoxyphenyl) -5-hydroxy-6-methoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

6,7,4-Trihydroxy-3,5-dimethoxyflavone

6,7-Dihydroxy-2- (4-hydroxy-3,5-dimethoxyphenyl) -4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

6-Hydroxykaempferol 3,4-dimethyl ether

5,6,7-Trihydroxy-3-methoxy-2- (4-methoxyphenyl) -4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

5,7,8-Trihydroxy-3,4-dimethoxyflavone

5,7,8-Trihydroxy-3-methoxy-2- (4-methoxyphenyl) -4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

Laurentinol

3,7-Dihydroxy-2- (4-hydroxy-3,5-dimethoxyphenyl) -4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

6-Hydroxyluteolin 5,6-dimethyl ether

7,3,4-Trihydroxy-5,6-dimethoxyflavone

C17H14O7 (330.0739494)


   

Isoetin 5,7-dimethyl ether

2,4,5-Trihydroxy-5,7-dimethoxyflavone

C17H14O7 (330.0739494)


   

Quercetin 5,4-dimethyl ether

Quercetin 5,4-dimethyl ether

C17H14O7 (330.0739494)


   

Herbacetin 7,4-dimethyl ether

3,5,8-Trihydroxy-7,4-dimethoxyflavone

C17H14O7 (330.0739494)


   

6-C-Methylquercetin 3-methyl ether

6-C-Methylquercetin 3-methyl ether

C17H14O7 (330.0739494)


   

8-C-Methylquercetin 3-methyl ether

5,7,3,4-Tetrahydroxy-3-methoxy-8-methylfavone

C17H14O7 (330.0739494)


   

6-Methoxyorobol 7-methyl ether

5,3,4-Trihydroxy-6,7-dimethoxyisoflavone

C17H14O7 (330.0739494)


   

1,3,5-Trihydroxy-2-methoxy-6-(methoxymethyl)anthraquinone

1,3,5-Trihydroxy-2-methoxy-6-(methoxymethyl)anthraquinone

C17H14O7 (330.0739494)


   

5,8,2-Trihydroxy-6,7-dimethoxyflavone

5,8,2-Trihydroxy-6,7-dimethoxyflavone

C17H14O7 (330.0739494)


   

5,6,8-Trihydroxy-7,4-dimethoxyflavone

5,6,8-Trihydroxy-7,4-dimethoxyflavone

C17H14O7 (330.0739494)


   

Jaceosidin

4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-methoxy-

C17H14O7 (330.0739494)


Jaceosidin, also known as 4,5,7-trihydroxy-3,6-dimethoxyflavone, is a member of the class of compounds known as 6-o-methylated flavonoids. 6-o-methylated flavonoids are flavonoids with methoxy groups attached to the C6 atom of the flavonoid backbone. Thus, jaceosidin is considered to be a flavonoid lipid molecule. Jaceosidin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Jaceosidin can be found in lemon verbena, which makes jaceosidin a potential biomarker for the consumption of this food product. Jaceosidin is a flavonoid isolated from Artemisia vestita, induces apoptosis in cancer cells, activates Bax and down-regulates Mcl-1 and c-FLIP expression[1]. Jaceosidin exhibits anti-cancer[2], anti-inflammatory activities, decreases leves of inflammatory markers, and suppresses COX-2 expression and NF-κB activation[3]. Jaceosidin is a flavonoid isolated from Artemisia vestita, induces apoptosis in cancer cells, activates Bax and down-regulates Mcl-1 and c-FLIP expression[1]. Jaceosidin exhibits anti-cancer[2], anti-inflammatory activities, decreases leves of inflammatory markers, and suppresses COX-2 expression and NF-κB activation[3].

   

5,7,2-Trihydroxy-8,6-dimethoxyflavone

5,7,2-Trihydroxy-8,6-dimethoxyflavone

C17H14O7 (330.0739494)


   

7,3,4-Trihydroxy-3,8-dimethoxyflavone

7,3,4-Trihydroxy-3,8-dimethoxyflavone

C17H14O7 (330.0739494)


A trihydroxyflavone that is flavone substituted by hydroxy groups at positions 7, 3 and 4 and methoxy groups at positions 3 and 8. Isolated from Mimosa diplotricha, it exhibits cytotoxic activity against human cancer cell lines.

   

Podospicatin

5,7,2-Trihydroxy-6,5-dimethoxyisoflavone

C17H14O7 (330.0739494)


   

Iristectorigenin A

5,7,3-Trihydroxy-6,4-dimethoxyisoflavone

C17H14O7 (330.0739494)


   

Iristectorigenin B

4H-1-Benzopyran-4-one, 5,7-dihydroxy-3-(4-hydroxy-3-methoxyphenyl)-6-methoxy-

C17H14O7 (330.0739494)


Iristectorigenin A is a natural product found in Iris japonica, Sophora tomentosa, and other organisms with data available. Iristectorigenin A is a natural isoflavone isolated from B. chinensis rhizomes. Iristectorigenin A shows antioxidant activity[1][2]. Iristectorigenin A is a natural isoflavone isolated from B. chinensis rhizomes. Iristectorigenin A shows antioxidant activity[1][2].

   

5,7,3-Trihydroxy-8,4-dimethoxyisoflavone

5,7,3-Trihydroxy-8,4-dimethoxyisoflavone

C17H14O7 (330.0739494)


   

2-Hydroxy-5-methoxybiochanin A

5,7,2-Trihydroxy-4,5-dimethoxyisoflavone

C17H14O7 (330.0739494)


   

5,7,8-Trihydroxy-3,6-dimethoxyflavone

5,7,8-Trihydroxy-3,6-dimethoxyflavone

C17H14O7 (330.0739494)


   

8,3,4-Trihydroxy-5,7-dimethoxy-4-phenylcoumarin

8,3,4-Trihydroxy-5,7-dimethoxy-4-phenylcoumarin

C17H14O7 (330.0739494)


   

Tamaridone

2,5,7-Trihydroxy-4,6-dimethoxyflavone

C17H14O7 (330.0739494)


   
   

Morelosin

3,5,7-Trihydroxy-3,5-dimethoxyflavone

C17H14O7 (330.0739494)


   

Rehderianin I

5,2,5-Trihydroxy-7,8-dimethoxyflavone

C17H14O7 (330.0739494)


   

Viscidulin II

5,2,6-Trihydroxy-7,8-dimethoxyflavone

C17H14O7 (330.0739494)


   

Cirsiliol

6-Hydroxyluteolin-6,7-dimethyl ether; 6-Methoxyluteolin 7-methyl ether; Crisiliol

C17H14O7 (330.0739494)


Cirsiliol is a dimethoxyflavone that is flavone substituted by methoxy groups at positions 6 and 7 and hydroxy groups at positions 5, 3 and 4 respectively. It has a role as a plant metabolite. It is a trihydroxyflavone and a dimethoxyflavone. It is functionally related to a flavone. Cirsiliol is a natural product found in Teucrium montanum, Thymus herba-barona, and other organisms with data available. A dimethoxyflavone that is flavone substituted by methoxy groups at positions 6 and 7 and hydroxy groups at positions 5, 3 and 4 respectively. Cirsiliol is a potent and selective 5-lipoxygenase inhibitor and a competitive low affinity benzodiazepine receptor ligand. Cirsiliol is a potent and selective 5-lipoxygenase inhibitor and a competitive low affinity benzodiazepine receptor ligand. Cirsiliol is a potent and selective 5-lipoxygenase inhibitor and a competitive low affinity benzodiazepine receptor ligand.

   

Desmethoxysudachitin

5,7-Dihydroxy-2- (4-hydroxyphenyl) -6,8-dimethoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

Trifolian

1,3-Dihydroxy-2-methoxy-8,9-methylenedioxypterocarpan

C17H14O7 (330.0739494)


   

Dillenetin

2- (3,4-Dimethoxyphenyl) -3,5,7-trihydroxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

Prudomestin

3,5,7-Trihydroxy-8-methoxy-2- (4-methoxyphenyl) -4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


Prudomestin, isolated from the heartwood of Prunus domestica, shows potent xanthine oxidase (XO) inhibitory activity (IC50≈6?μM)[1][2].

   

Quercetin 3,7-dimethyl ether

2- (3,4-Dihydroxyphenyl) -5-hydroxy-3,7-dimethoxy-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

Remerin

(-) -2- (3,4-Dihydro-5-hydroxy-7-methoxy-4-oxo-2H-1-benzopyran-2-yl) -5-methoxy-2,5-cyclohexadiene-1,4-dione

C17H14O7 (330.0739494)


   

Tricin

4H-1-BENZOPYRAN-4-ONE, 5,7-DIHYDROXY-2-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-

C17H14O7 (330.0739494)


3,5-di-O-methyltricetin is the 3,5-di-O-methyl ether of tricetin. Known commonly as tricin, it is a constituent of rice bran and has been found to potently inhibit colon cancer cell growth. It has a role as an EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor and a metabolite. It is a trihydroxyflavone, a dimethoxyflavone and a member of 3-methoxyflavones. It is functionally related to a tricetin. It is a conjugate acid of a 3,5-di-O-methyltricetin(1-). Tricin is a natural product found in Carex fraseriana, Smilax bracteata, and other organisms with data available. See also: Arnica montana Flower (part of); Elymus repens root (part of). The 3,5-di-O-methyl ether of tricetin. Known commonly as tricin, it is a constituent of rice bran and has been found to potently inhibit colon cancer cell growth. Isolated from Triticum dicoccum (emmer). Tricin 5-diglucoside is found in wheat and cereals and cereal products. From leaves of Oryza sativa (rice). 5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4h-chromen-4-one, also known as 3,5-O-dimethyltricetin or 5,7,4-trihydroxy-3,5-dimethoxy-flavone, is a member of the class of compounds known as 3-o-methylated flavonoids. 3-o-methylated flavonoids are flavonoids with methoxy groups attached to the C3 atom of the flavonoid backbone. Thus, 5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4h-chromen-4-one is considered to be a flavonoid lipid molecule. 5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4h-chromen-4-one is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4h-chromen-4-one can be synthesized from tricetin. 5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4h-chromen-4-one is also a parent compound for other transformation products, including but not limited to, tricin 7-O-glucoside, 4-O-beta-glucosyl-7-O-(6-O-sinapoylglucosyl)tricin, and tricin 7-O-(6-O-malonyl)-beta-D-glucopyranoside. 5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4h-chromen-4-one can be found in barley, common wheat, oat, and rice, which makes 5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4h-chromen-4-one a potential biomarker for the consumption of these food products. Tricin is a natural flavonoid present in large amounts in Triticum aestivum. Tricin can inhibit human cytomegalovirus (HCMV) replication by inhibiting CDK9. Tricin inhibits the proliferation and invasion of C6 glioma cells via the upregulation of focal-adhesion-finase (FAK)-targeting microRNA-7[1][2][3]. Tricin is a natural flavonoid present in large amounts in Triticum aestivum. Tricin can inhibit human cytomegalovirus (HCMV) replication by inhibiting CDK9. Tricin inhibits the proliferation and invasion of C6 glioma cells via the upregulation of focal-adhesion-finase (FAK)-targeting microRNA-7[1][2][3].

   
   

4,6-dihydroxy-2-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-3-benzofuranone

4,6-dihydroxy-2-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-3-benzofuranone

C17H14O7 (330.0739494)


   
   

3,6-Dimethoxyapigenin

3,6-Dimethoxyapigenin

C17H14O7 (330.0739494)


   

Malvidin chloride

Malvidin chloride

C17H14O7 (330.0739494)


   

5,7-Di-O-methylquercetin

5,7-Di-O-methylquercetin

C17H14O7 (330.0739494)


   

4,6,7-trihydroxy-3,5-dimethoxyflavone

4,6,7-trihydroxy-3,5-dimethoxyflavone

C17H14O7 (330.0739494)


   
   

1,2,7-trihydroxy-6 ,8-dimethoxy-3-methylanthraqu inone

1,2,7-trihydroxy-6 ,8-dimethoxy-3-methylanthraqu inone

C17H14O7 (330.0739494)


   

(+)-(6S,8R,9R)-8-bromo-9-chloro-5,5,9-trimethyl-1-methylidenespiro<5.5>undec-3-en-2-one|(+)-(6S,8R,9R)-8-bromo-9-chloro-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-3-en-2-one|(8R,9R)-8-bromo-9-chloro-5,5,9-trimethyl-1-methylidenespiro<5.5>undec-3-en-2-one|(8R,9R)-8-bromo-9-chloro-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-3-en-2-one

(+)-(6S,8R,9R)-8-bromo-9-chloro-5,5,9-trimethyl-1-methylidenespiro<5.5>undec-3-en-2-one|(+)-(6S,8R,9R)-8-bromo-9-chloro-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-3-en-2-one|(8R,9R)-8-bromo-9-chloro-5,5,9-trimethyl-1-methylidenespiro<5.5>undec-3-en-2-one|(8R,9R)-8-bromo-9-chloro-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-3-en-2-one

C15H20BrClO (330.03859600000004)


   
   
   
   
   

Patuletin|spinacetin

Patuletin|spinacetin

C17H14O7 (330.0739494)


   

4,5,8-trihydroxy-3,7-dimethoxyflavone|5,8,4-trihydroxy-7,3-dimethoxyflavone

4,5,8-trihydroxy-3,7-dimethoxyflavone|5,8,4-trihydroxy-7,3-dimethoxyflavone

C17H14O7 (330.0739494)


   

3,5,8-Trihydroxy-2,7-dimethoxyisoflavone

3,5,8-Trihydroxy-2,7-dimethoxyisoflavone

C17H14O7 (330.0739494)


   

4-Methylcapillarisin

4-Methylcapillarisin

C17H14O7 (330.0739494)


   

Hurgadenyne|Hurgadenyne (rel.(1S,3R,4S)-4-(1-bromonona-3,6-cis,cis-dien-8-ynyl)-2-chloro-3-ethyl-1,2,3,4-tetrahydrofuran)|Hurgadenyne [rel.(1S,3R,4S)-4-(1-bromonona-3,6-cis,cis-dien-8-ynyl)-2-chloro-3-ethyl-1,2,3,4-tetrahydrofuran]

Hurgadenyne|Hurgadenyne (rel.(1S,3R,4S)-4-(1-bromonona-3,6-cis,cis-dien-8-ynyl)-2-chloro-3-ethyl-1,2,3,4-tetrahydrofuran)|Hurgadenyne [rel.(1S,3R,4S)-4-(1-bromonona-3,6-cis,cis-dien-8-ynyl)-2-chloro-3-ethyl-1,2,3,4-tetrahydrofuran]

C15H20BrClO (330.03859600000004)


   
   
   
   

6-Me ether-3-(3,4-Dihydroxybenzylidene)-5,6,7-trihydroxy-4-chromanone

6-Me ether-3-(3,4-Dihydroxybenzylidene)-5,6,7-trihydroxy-4-chromanone

C17H14O7 (330.0739494)


   
   

7-methylcapillarisin|capillartemisin-7-methyl ether

7-methylcapillarisin|capillartemisin-7-methyl ether

C17H14O7 (330.0739494)


   

3,6,7-Trihydroxy-2,5-dimethoxyisoflavone

3,6,7-Trihydroxy-2,5-dimethoxyisoflavone

C17H14O7 (330.0739494)


   
   
   

Aflatoxin B2a

5-hydroxy-11-methoxy-6,8,19-trioxapentacyclo[10.7.0.0^{2,9}.0^{3,7}.0^{13,17}]nonadeca-1,9,11,13(17)-tetraene-16,18-dione

C17H14O7 (330.0739494)


   

4,5,6-Trihydroxy-3,7-dimethoxyisoflavone

4,5,6-Trihydroxy-3,7-dimethoxyisoflavone

C17H14O7 (330.0739494)


   

3,5,7-Trihydroxy-4,8-dimethoxyisoflavone

3,5,7-Trihydroxy-4,8-dimethoxyisoflavone

C17H14O7 (330.0739494)


   

2,7-dihydroxy-3-(3-methoxy-4-hydroxy)-5-methoxyisoflavone

2,7-dihydroxy-3-(3-methoxy-4-hydroxy)-5-methoxyisoflavone

C17H14O7 (330.0739494)


   

4,7-Dihydroxy-2,5-dimethoxy-flavonol

4,7-Dihydroxy-2,5-dimethoxy-flavonol

C17H14O7 (330.0739494)


   
   
   

3,7,8-Trihydroxy-4,6-dimethoxyisoflavone

3,7,8-Trihydroxy-4,6-dimethoxyisoflavone

C17H14O7 (330.0739494)


   

Eupalitin

6,7-Dimethoxy-3,5,4-trihydroxyflavone

C17H14O7 (330.0739494)


   

9,10-Anthracenedione, 1,3,5-trihydroxy-4,7-dimethoxy-2-methyl-

9,10-Anthracenedione, 1,3,5-trihydroxy-4,7-dimethoxy-2-methyl-

C17H14O7 (330.0739494)


   
   

3,7-Dimethylquercetin

3,7-Dimethylquercetin

C17H14O7 (330.0739494)


   
   

2,2-Dimethoxy-3,3-dihydroxy-5,5-oxygen-6,6-biphenylformic anhydride

2,2-Dimethoxy-3,3-dihydroxy-5,5-oxygen-6,6-biphenylformic anhydride

C16H10O8 (330.037566)


   
   

Ceroalbolinic acid

Ceroalbolinic acid

C16H10O8 (330.037566)


   

7,8,9-Trimethoxy-10H-1,3-dioxolo[4,5-b]xanthen-10-one

7,8,9-Trimethoxy-10H-1,3-dioxolo[4,5-b]xanthen-10-one

C17H14O7 (330.0739494)


   

5,6,4-trihydroxy-8,3-dimethoxyflavone

5,6,4-trihydroxy-8,3-dimethoxyflavone

C17H14O7 (330.0739494)


   

2,6,3-Trichloro-3-hydroxy-4-methoxybibenzyl

2,6,3-Trichloro-3-hydroxy-4-methoxybibenzyl

C15H13Cl3O2 (329.9981088)


   

(3R,4S)-3-acetyl-5,7-dihydroxy-4-(3,4-dihydroxyphenyl)-3,4-dihydroisocoumarin|phayomphenol B1

(3R,4S)-3-acetyl-5,7-dihydroxy-4-(3,4-dihydroxyphenyl)-3,4-dihydroisocoumarin|phayomphenol B1

C17H14O7 (330.0739494)


   
   

3,7,3-trihydroxy-5,6-dimethoxyflavone

3,7,3-trihydroxy-5,6-dimethoxyflavone

C17H14O7 (330.0739494)


   

COC1=CC(OC)=C2C(=O)C(=COC2=C1)C1=CC(O)=C(O)C(O)=C1

COC1=CC(OC)=C2C(=O)C(=COC2=C1)C1=CC(O)=C(O)C(O)=C1

C17H14O7 (330.0739494)


   
   

ellagic acid 3,3-dimethyl ether

ellagic acid 3,3-dimethyl ether

C16H10O8 (330.037566)


   

4,8-Dihydroxy-6-(2-hydroxyethyl)-9-oxo-9H-xanthene-1-carboxylic acid methyl ester

4,8-Dihydroxy-6-(2-hydroxyethyl)-9-oxo-9H-xanthene-1-carboxylic acid methyl ester

C17H14O7 (330.0739494)


   

2-(2,3-dihydroxy-4-methoxyphenyl)-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one|loasin A

2-(2,3-dihydroxy-4-methoxyphenyl)-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one|loasin A

C17H14O7 (330.0739494)


   

6,7-dimethoxy-5,2,4-trihydroxyisoflavone

6,7-dimethoxy-5,2,4-trihydroxyisoflavone

C17H14O7 (330.0739494)


   

C1=CC(OC)=CC=C1CCC1=CC(=O)C2=CC(O)=CC(Cl)=C2O1

C1=CC(OC)=CC=C1CCC1=CC(=O)C2=CC(O)=CC(Cl)=C2O1

C18H15ClO4 (330.06588200000004)


   

4H-1-Benzopyran-4-one, 5,7-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-6-methoxy-

4H-1-Benzopyran-4-one, 5,7-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-6-methoxy-

C17H14O7 (330.0739494)


   
   
   

5,2,3-trihydroxy-7,6-dimethoxyflavone|loasifolin

5,2,3-trihydroxy-7,6-dimethoxyflavone|loasifolin

C17H14O7 (330.0739494)


   

1-Desmethylobtusin

1-Desmethylobtusin

C17H14O7 (330.0739494)


   
   

1-Methyl-3,6,7,8-tetrahydroxy-anthrachinon-2-carbonsaeure (Ceroalbolinsaeure)|Ceroalbolinsaeure

1-Methyl-3,6,7,8-tetrahydroxy-anthrachinon-2-carbonsaeure (Ceroalbolinsaeure)|Ceroalbolinsaeure

C16H10O8 (330.037566)


   

4,5,7-Trihydroxy-6,8-dimethoxyisoflavone

4,5,7-Trihydroxy-6,8-dimethoxyisoflavone

C17H14O7 (330.0739494)


   

3,5,6-Trihydroxy-2,7-dimethoxyisoflavone

3,5,6-Trihydroxy-2,7-dimethoxyisoflavone

C17H14O7 (330.0739494)


   

7,8-Di-Me ether-2,3,5,7,8-Pentahydroxyflavone

7,8-Di-Me ether-2,3,5,7,8-Pentahydroxyflavone

C17H14O7 (330.0739494)


   
   

3,8-Dimethoxy-4,5,7-trihydroxyisoflavone

3,8-Dimethoxy-4,5,7-trihydroxyisoflavone

C17H14O7 (330.0739494)


   

5,6-Di-Me ether-3,5,5,6,7-Pentahydroxyflavone

5,6-Di-Me ether-3,5,5,6,7-Pentahydroxyflavone

C17H14O7 (330.0739494)


   

1,7,8-Trimethoxy-2,3-(methylenebisoxy)xanthone

1,7,8-Trimethoxy-2,3-(methylenebisoxy)xanthone

C17H14O7 (330.0739494)


   

3,5,6,7,8-Pentahydroxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one

3,5,6,7,8-Pentahydroxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

1,4,5,7-Tetrahydroxy-2-(1-hydroxypropyl)anthraquinone

1,4,5,7-Tetrahydroxy-2-(1-hydroxypropyl)anthraquinone

C17H14O7 (330.0739494)


   

Isopolygalaxanthone A

Isopolygalaxanthone A

C17H14O7 (330.0739494)


   

3,5,5-Trihydroxy-4,7-dimethoxyflavone

3,5,5-Trihydroxy-4,7-dimethoxyflavone

C17H14O7 (330.0739494)


   

5,6,7,3,4-Pentahydroxy-3-methoxyflavone

5,6,7,3,4-Pentahydroxy-3-methoxyflavone

C17H14O7 (330.0739494)


   

omega-hydroxyxanthorin 1-O-methyl ether

omega-hydroxyxanthorin 1-O-methyl ether

C17H14O7 (330.0739494)


   

rhodolamprometrin

rhodolamprometrin

C16H10O8 (330.037566)


   
   

3,5,8-Trihydroxy-7,4-dimethoxyflavone

3,5,8-Trihydroxy-7,4-dimethoxyflavone

C17H14O7 (330.0739494)


   

3-O-methylpannaric acid

3-O-methylpannaric acid

C17H14O7 (330.0739494)


   
   

Quercetin 3,3-dimethyl ether

5,7,4-Trihydroxy-3,3-dimethoxyflavone

C17H14O7 (330.0739494)


   

2,5-dihydroxy-1,3,4-trimethoxyanthraquinone

2,5-dihydroxy-1,3,4-trimethoxyanthraquinone

C17H14O7 (330.0739494)


   

4,3-di-O-methylellagic acid

4,3-di-O-methylellagic acid

C16H10O8 (330.037566)


   

7-Me ether-3-(3,4-Dihydroxybenzylidene)-5,7,8-trihydroxy-4-chromanone

7-Me ether-3-(3,4-Dihydroxybenzylidene)-5,7,8-trihydroxy-4-chromanone

C17H14O7 (330.0739494)


   

1,2-Dimethoxy-3,5,8-trihydroxy-6-methyl-9,10-anthraquinone

1,2-Dimethoxy-3,5,8-trihydroxy-6-methyl-9,10-anthraquinone

C17H14O7 (330.0739494)


   
   

3,4,10-trihydroxy-8-methoxy-6,12-dioxab enz[a)anthracen-7(5h,6h,12ah)-one

3,4,10-trihydroxy-8-methoxy-6,12-dioxab enz[a)anthracen-7(5h,6h,12ah)-one

C17H14O7 (330.0739494)


   
   

Desmethoxycentaureidin

Desmethoxycentaureidin

C17H14O7 (330.0739494)


   

1,5,7-Trihydroxy-2-methyl-4,6-dimethoxyanthracene-9,10-dione

1,5,7-Trihydroxy-2-methyl-4,6-dimethoxyanthracene-9,10-dione

C17H14O7 (330.0739494)


   

2,5,6-Trihydroxy-7,8-dimethoxyflavone

2,5,6-Trihydroxy-7,8-dimethoxyflavone

C17H14O7 (330.0739494)


   
   

Pannaric acid 6-methyl

Pannaric acid 6-methyl

C17H14O7 (330.0739494)


   

5,7,4-Trihydroxy-8,3-dimethoxyflavone

5,7,4-Trihydroxy-8,3-dimethoxyflavone

C17H14O7 (330.0739494)


   

O=C1C(C=CC=CC(C)=O)=C(O)C(=O)C2=C(O)C(OC)=CC(O)=C21

O=C1C(C=CC=CC(C)=O)=C(O)C(=O)C2=C(O)C(OC)=CC(O)=C21

C17H14O7 (330.0739494)


   

1,7-dihydroxy-5,6,8-trimethoxyanthraquinone

1,7-dihydroxy-5,6,8-trimethoxyanthraquinone

C17H14O7 (330.0739494)


   

NCI60_032209

3,5,7-Trihydroxy-4,6-dimethoxyflavone; 6-Methoxyluteolin 4-methyl ether; Demethoxycentaureidin; NSC 689466

C17H14O7 (330.0739494)


Desmethoxycentaureidin is a natural product found in Centaurea bracteata, Centaurea cineraria, and other organisms with data available.

   

3,3-Dimethylquercetin

4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-methoxy-

C17H14O7 (330.0739494)


3,3-dimethylquercetin is a dimethoxyflavone that is quercetin in which the hydroxy groups at position 3 and 3 have been replaced by methoxy groups. It has been isolated from several plant species and exhibits anti-bacterial and anti-cancer properties. It has a role as a plant metabolite, an antibacterial agent, an antineoplastic agent and an apoptosis inducer. It is a trihydroxyflavone, a dimethoxyflavone and a member of 3-methoxyflavones. It is functionally related to a quercetin. Quercetin 3,3-dimethyl ether is a natural product found in Psiadia viscosa, Cleome amblyocarpa, and other organisms with data available. A dimethoxyflavone that is quercetin in which the hydroxy groups at position 3 and 3 have been replaced by methoxy groups. It has been isolated from several plant species and exhibits anti-bacterial and anti-cancer properties.

   

furosemide

furosemide

C12H11ClN2O5S (330.00771860000003)


D045283 - Natriuretic Agents > D004232 - Diuretics > D049994 - Sodium Potassium Chloride Symporter Inhibitors C - Cardiovascular system > C03 - Diuretics > C03C - High-ceiling diuretics > C03CA - Sulfonamides, plain C78275 - Agent Affecting Blood or Body Fluid > C448 - Diuretic > C49184 - Loop Diuretic D002317 - Cardiovascular Agents > D045283 - Natriuretic Agents D000890 - Anti-Infective Agents > D013424 - Sulfanilamides D049990 - Membrane Transport Modulators CONFIDENCE standard compound; INTERNAL_ID 635; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3731; ORIGINAL_PRECURSOR_SCAN_NO 3727 CONFIDENCE standard compound; INTERNAL_ID 635; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3749; ORIGINAL_PRECURSOR_SCAN_NO 3747 CONFIDENCE standard compound; INTERNAL_ID 635; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3780; ORIGINAL_PRECURSOR_SCAN_NO 3777 CONFIDENCE standard compound; INTERNAL_ID 635; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3741; ORIGINAL_PRECURSOR_SCAN_NO 3739 CONFIDENCE standard compound; INTERNAL_ID 635; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3729; ORIGINAL_PRECURSOR_SCAN_NO 3727 CONFIDENCE standard compound; INTERNAL_ID 635; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3727; ORIGINAL_PRECURSOR_SCAN_NO 3723 CONFIDENCE standard compound; INTERNAL_ID 2692 CONFIDENCE standard compound; INTERNAL_ID 4078 CONFIDENCE standard compound; INTERNAL_ID 8501 Furosemide is a potent and orally active inhibitor of Na+/K+/2Cl-?(NKCC) cotransporter, NKCC1 and NKCC2[1].?Furosemide is also a GABAA?receptors antagonist and displays 100-fold selectivity for?α6-containing receptors than?α1-containing receptors. Furosemide acts as a loop diuretic and used for the study of congestive heart failure, hypertension and edema[2].

   

2-(3,4-dihydroxyphenyl)-5-hydroxy-6,7-dimethoxychromen-4-one

NCGC00385220-01!2-(3,4-dihydroxyphenyl)-5-hydroxy-6,7-dimethoxychromen-4-one

C17H14O7 (330.0739494)


   

Aflatoxin G2

aflatoxin g2

C17H14O7 (330.0739494)


Aflatoxin G2 is a natural product found in Aspergillus nomiae, Glycyrrhiza uralensis, and other organisms, and is a very light and fluffy crystalline solid. Exhibits green-blue fluorescence. (NTP, 1992) National Toxicology Program, Institute of Environmental Health Sciences, National Institutes of Health (NTP). 1992. National Toxicology Program Chemical Repository Database. Research Triangle Park, North Carolina.

   

(2Z)-4,6-dihydroxy-2-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-1-benzofuran-3-one

(2Z)-4,6-dihydroxy-2-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-1-benzofuran-3-one

C17H14O7 (330.0739494)


   

3-(1,2-dihydroxypropyl)-1,6,8-trihydroxyanthracene-9,10-dione

3-(1,2-dihydroxypropyl)-1,6,8-trihydroxyanthracene-9,10-dione

C17H14O7 (330.0739494)


   

4,5,7-Trihydroxy-3,6-dimethoxyflavone

4,5,7-Trihydroxy-3,6-dimethoxyflavone

C17H14O7 (330.0739494)


   

Flavone base + 3O, 2MeO

Flavone base + 3O, 2MeO

C17H14O7 (330.0739494)


Annotation level-3

   

FENARIMOL

Pesticide6_Fenarimol_C17H12Cl2N2O_(2-Chlorophenyl)(4-chlorophenyl)5-pyrimidinylmethanol

C17H12Cl2N2O (330.0326642)


D016573 - Agrochemicals D010575 - Pesticides

   

5,7-dihydroxy-2-(4-hydroxyphenyl)-3,6-dimethoxy-4H-chromen-4-one

5,7-dihydroxy-2-(4-hydroxyphenyl)-3,6-dimethoxy-4H-chromen-4-one

C17H14O7 (330.0739494)


   

5-HYDROXYDANTROLENE

5-HYDROXYDANTROLENE

C14H10N4O6 (330.060032)


   

Enidin

2-(4-hydroxy-3,5-dimethoxyphenyl)chromenylium-3,5,7-triol

C17H14O7 (330.0739494)


   
   

Caryatin

3,5-Di-O-methylquercetin

C17H14O7 (330.0739494)


   

6-Methoxykaempferol 3-methyl ether

4,5,7-Trihydroxy-3,6-dimethoxyflavone

C17H14O7 (330.0739494)


   

2,3 Cyclic imp

Inosine cyclic 2,3-(hydrogen phosphate)

C10H11N4O7P (330.03653460000004)


   

AFLATOXIN M2

(3R,7R)-3-hydroxy-11-methoxy-6,8,19-trioxapentacyclo[10.7.0.0^{2,9}.0^{3,7}.0^{13,17}]nonadeca-1,9,11,13(17)-tetraene-16,18-dione

C17H14O7 (330.0739494)


D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins D009676 - Noxae > D011042 - Poisons > D000348 - Aflatoxins

   

Petasiphenone

2-(3,4-dihydroxyphenyl)-2-oxoethyl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate

C17H14O7 (330.0739494)


   

1,3,5-Trihydroxy-6,7-dimethoxy-2-methylanthraquinone

1,3,5-trihydroxy-6,7-dimethoxy-2-methyl-9,10-dihydroanthracene-9,10-dione

C17H14O7 (330.0739494)


   

pilosin

5,7,8-trihydroxy-6-methoxy-2-(4-methoxyphenyl)-4H-chromen-4-one

C17H14O7 (330.0739494)


A dimethoxyflavone that is flavone carrying hydroxy groups at positions 5, 7, and 8, and methoxy groups at positions 4 and 6.

   

cicerin

5,7-dihydroxy-3-(6-methoxy-2H-1,3-benzodioxol-5-yl)-3,4-dihydro-2H-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

2,3-Di-O-methylellagic acid

13,14-dihydroxy-6,7-dimethoxy-2,9-dioxatetracyclo[6.6.2.0^{4,16}.0^{11,15}]hexadeca-1(15),4(16),5,7,11,13-hexaene-3,10-dione

C16H10O8 (330.037566)


   

2,8-Di-O-methylellagic acid

7,13-dihydroxy-6,14-dimethoxy-2,9-dioxatetracyclo[6.6.2.0^{4,16}.0^{11,15}]hexadeca-1(15),4(16),5,7,11,13-hexaene-3,10-dione

C16H10O8 (330.037566)


   

5,7-Dihydroxy-8,4'-dimethoxyisoflavone

5,7-dihydroxy-3-(2-hydroxy-4-methoxyphenyl)-8-methoxy-4H-chromen-4-one

C17H14O7 (330.0739494)


   

3-(1,2-Dihydroxypropyl)-1,6,8-trihydroxy-9,10-anthraquinone

3-(1,2-Dihydroxypropyl)-1,6,8-trihydroxy-9,10-anthraquinone

C17H14O7 (330.0739494)


   

10-demethyl boeravinone C

10-demethyl boeravinone C

C17H14O7 (330.0739494)


   

METHYL 1-TOSYL-1H-PYRROLO[2,3-B]PYRIDINE-3-CARBOXYLATE

METHYL 1-TOSYL-1H-PYRROLO[2,3-B]PYRIDINE-3-CARBOXYLATE

C16H14N2O4S (330.06742440000005)


   

methyl 1-(4-methylphenyl)sulfonylpyrrolo[3,2-b]pyridine-2-carboxylate

methyl 1-(4-methylphenyl)sulfonylpyrrolo[3,2-b]pyridine-2-carboxylate

C16H14N2O4S (330.06742440000005)


   
   

3-allyl-5-(4-methoxyphenyl)-2-sulfanylthieno[2,3-d]pyrimidin-4(3h)-one

3-allyl-5-(4-methoxyphenyl)-2-sulfanylthieno[2,3-d]pyrimidin-4(3h)-one

C16H14N2O2S2 (330.0496664)


   
   

halauxifen

halauxifen

C13H9Cl2FN2O3 (329.99742359999993)


A pyridinemonocarboxylic acid that is 4-amino-3-chloropyridine-2-carboxylic acid which is substituted by a 4-chloro-2-fluoro-3-methoxyphenyl group at position 6. It is a herbicide used for the control of broad-leaved weeds in cereals and oilseed rape.

   

2-(2,4-DINITROBENZYLTHIO)-1H-BENZO[D]IMIDAZOLE

2-(2,4-DINITROBENZYLTHIO)-1H-BENZO[D]IMIDAZOLE

C14H10N4O4S (330.042274)


   

SODIUM 4-((2,3-DIHYDROTHIENO[3,4-B][1,4]DIOXIN-2-YL)METHOXY)BUTANE-1-SULFONATE

SODIUM 4-((2,3-DIHYDROTHIENO[3,4-B][1,4]DIOXIN-2-YL)METHOXY)BUTANE-1-SULFONATE

C11H15NaO6S2 (330.020773)


   

LUCIFERIN 6-ETHYL ETHER SODIUM SALT

LUCIFERIN 6-ETHYL ETHER SODIUM SALT

C13H11N2NaO3S2 (330.0108776)


   

4-[(2-chloro-5-(trifluoromethyl)phenoxy)methyl]phenylboronic acid

4-[(2-chloro-5-(trifluoromethyl)phenoxy)methyl]phenylboronic acid

C14H11BClF3O3 (330.0441832)


   

3-((2-Chloro-5-(trifluoromethyl)phenoxy)methyl)phenylboronic acid

3-((2-Chloro-5-(trifluoromethyl)phenoxy)methyl)phenylboronic acid

C14H11BClF3O3 (330.0441832)


   

ethyl 2-but-3-enyl-5-iodobenzoate

ethyl 2-but-3-enyl-5-iodobenzoate

C13H15IO2 (330.01167599999997)


   
   
   

Iron,[N-[2-[bis[(carboxy-kO)methyl]amino-kN]ethyl]-N-[2-(hydroxy-kO)ethyl]glycinato(3-)-kN,kO]-

Iron,[N-[2-[bis[(carboxy-kO)methyl]amino-kN]ethyl]-N-[2-(hydroxy-kO)ethyl]glycinato(3-)-kN,kO]-

C10H14FeN2O7++ (330.0150364)


   

N-[1-(2-HYDROXY-2-PHENYL-ETHYL)-PIPERIDIN-4-YL]-N-PHENYL-PROPIONAMIDE

N-[1-(2-HYDROXY-2-PHENYL-ETHYL)-PIPERIDIN-4-YL]-N-PHENYL-PROPIONAMIDE

C11H14ClF3N2O2S (330.041657)


   

1-(3-Chlorobenzyl)-1,2,3,4-tetrahydroquinoxaline

1-(3-Chlorobenzyl)-1,2,3,4-tetrahydroquinoxaline

C15H17Cl3N2 (330.04572520000005)


   

4-[(4-chlorophenyl)methyl]-2,3-dihydro-1H-quinoxaline

4-[(4-chlorophenyl)methyl]-2,3-dihydro-1H-quinoxaline

C15H17Cl3N2 (330.04572520000005)


   

(7-Bromo-2,3-dihydro-1,4-benzodioxin-6-yl)(4-methylphenyl)methanone

(7-Bromo-2,3-dihydro-1,4-benzodioxin-6-yl)(4-methylphenyl)methanone

C12H6ClF3N4S (329.9953782)


   

2-(2-(Bromomethyl)-4-chlorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(2-(Bromomethyl)-4-chlorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C13H17BBrClO2 (330.01934220000004)


   

2-(2-Iodophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(2-Iodophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C12H16BIO2 (330.0288056)


   

Cobalt (1+), bis(1,2-ethanediamine-N,N)bis(nitrito-N)-, (OC-6-12)-, nitrate

Cobalt (1+), bis(1,2-ethanediamine-N,N)bis(nitrito-N)-, (OC-6-12)-, nitrate

C4H13CoN7O7+++ (330.0208408)


   

ETHYL 1-(PHENYLSULFONYL)-1H-PYRROLO[2,3-B]PYRIDINE-2-CARBOXYLATE

ETHYL 1-(PHENYLSULFONYL)-1H-PYRROLO[2,3-B]PYRIDINE-2-CARBOXYLATE

C16H14N2O4S (330.06742440000005)


   

sodium,[4-[2-(4-hydroxyphenyl)propan-2-yl]phenyl] sulfate

sodium,[4-[2-(4-hydroxyphenyl)propan-2-yl]phenyl] sulfate

C15H15NaO5S (330.053786)


   
   

(5S)-N-[3-(4-BROMO-3-FLUOROPHENYL)-2-OXOOXAZOLIDIN-5-YLMETHYL]ACETAMIDE

(5S)-N-[3-(4-BROMO-3-FLUOROPHENYL)-2-OXOOXAZOLIDIN-5-YLMETHYL]ACETAMIDE

C12H12BrFN2O3 (330.0015274)


   
   

bis(trifluoro-2,4-pentanedionato)magnesium(ii)

bis(trifluoro-2,4-pentanedionato)magnesium(ii)

C10H8F6MgO4 (330.017726)


   
   

5-[3,5-bis(trifluoromethyl)phenyl]-3-(chloromethyl)-1,2,4-oxadiazole

5-[3,5-bis(trifluoromethyl)phenyl]-3-(chloromethyl)-1,2,4-oxadiazole

C11H5ClF6N2O (329.9994582)


   

N-(4-THIOPHEN-2-YL-THIAZOL-2-YL)PHTHALAMICACID

N-(4-THIOPHEN-2-YL-THIAZOL-2-YL)PHTHALAMICACID

C15H10N2O3S2 (330.013283)


   

1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, 1-(phenylsulfonyl)-, ethyl ester

1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, 1-(phenylsulfonyl)-, ethyl ester

C16H14N2O4S (330.06742440000005)


   

3-(1-(2,6-DICHLORO-3-FLUOROPHENYL)ETHOXY)-2-NITROPYRIDINE

3-(1-(2,6-DICHLORO-3-FLUOROPHENYL)ETHOXY)-2-NITROPYRIDINE

C13H9Cl2FN2O3 (329.99742359999993)


   

3,3,4,4-Biphenyltetracarboxylic acid

3,3,4,4-Biphenyltetracarboxylic acid

C16H10O8 (330.037566)


   

1-(3,4-DIMETHYLPHENYL)-3-METHYL-3-PYRAZOLIN-5-ONE

1-(3,4-DIMETHYLPHENYL)-3-METHYL-3-PYRAZOLIN-5-ONE

C15H8F6N2 (330.05916399999995)


   

calcium,5-phenyl-1,2,3-triaza-4-azanidacyclopenta-2,5-diene

calcium,5-phenyl-1,2,3-triaza-4-azanidacyclopenta-2,5-diene

C14H10CaN8 (330.065429)


   

ETHYL 6,6-DIMETHYL-3-(METHYLSULFONYL)-4-OXO-4,5,6,7-TETRAHYDROBENZO[C]THIOPHENE-1-CARBOXYLATE

ETHYL 6,6-DIMETHYL-3-(METHYLSULFONYL)-4-OXO-4,5,6,7-TETRAHYDROBENZO[C]THIOPHENE-1-CARBOXYLATE

C14H18O5S2 (330.0595618)


   

2-(2-bromo-5-methoxyphenyl)-4-pyridin-2-yl-1,3-oxazole

2-(2-bromo-5-methoxyphenyl)-4-pyridin-2-yl-1,3-oxazole

C15H11BrN2O2 (330.00038459999996)


   

6-BROMO-3-PHENYL-IMIDAZO[1,2-A]PYRIDINE-2-CARBOXYLIC ACID METHYL ESTER

6-BROMO-3-PHENYL-IMIDAZO[1,2-A]PYRIDINE-2-CARBOXYLIC ACID METHYL ESTER

C15H11BrN2O2 (330.00038459999996)


   

ethyl 3-[1-(3-chlorophenyl)-2-ethoxy-2-oxoethyl]sulfanylpropanoate

ethyl 3-[1-(3-chlorophenyl)-2-ethoxy-2-oxoethyl]sulfanylpropanoate

C15H19ClO4S (330.06925240000004)


   

2-BENZYLAMINO-5-TRIFLUOROMETHYL-BENZENESULFONAMIDE

2-BENZYLAMINO-5-TRIFLUOROMETHYL-BENZENESULFONAMIDE

C14H13F3N2O2S (330.0649794)


   

4-[(2-chlorophenyl)methyl]-2,3-dihydro-1H-quinoxaline

4-[(2-chlorophenyl)methyl]-2,3-dihydro-1H-quinoxaline

C15H17Cl3N2 (330.04572520000005)


   

2-(4-Bromo-2-fluoro-5-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(4-Bromo-2-fluoro-5-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C13H17BBrFO3 (330.0438074)


   

Pirazolac

Pirazolac

C17H12ClFN2O2 (330.05712939999995)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic

   

Benzoic acid, lead(2+)salt (2:1)

Benzoic acid, lead(2+)salt (2:1)

C7H6O2Pb (330.0134186)


   

Biphenyl-3,3,5,5-tetracarboxylic acid

Biphenyl-3,3,5,5-tetracarboxylic acid

C16H10O8 (330.037566)


   

6-Chloro-5-(2-methoxyphenoxy)-2,2-bipyrimidin-4(5H)-one

6-Chloro-5-(2-methoxyphenoxy)-2,2-bipyrimidin-4(5H)-one

C15H11ClN4O3 (330.0519646)


   

2,2,3,3,5,5,6,6-Octafluoro-4,4-biphenyldiol

2,2,3,3,5,5,6,6-Octafluoro-4,4-biphenyldiol

C12H2F8O2 (329.99270479999996)


   
   

ethyl 3-[1-(2-chlorophenyl)-2-ethoxy-2-oxoethyl]sulfanylpropanoate

ethyl 3-[1-(2-chlorophenyl)-2-ethoxy-2-oxoethyl]sulfanylpropanoate

C15H19ClO4S (330.06925240000004)


   

2-(3-iodophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(3-iodophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C12H16BIO2 (330.0288056)


   

4-IODOPHENYLBORONIC ACID PINACOL ESTER

4-IODOPHENYLBORONIC ACID PINACOL ESTER

C12H16BIO2 (330.0288056)


   

Plumbane,chlorotriethyl-

Plumbane,chlorotriethyl-

C6H15ClPb (330.062863)


   

(R)-3-(1-(2,6-Dichloro-3-fluorophenyl)ethoxy)-2-nitropyridine

(R)-3-(1-(2,6-Dichloro-3-fluorophenyl)ethoxy)-2-nitropyridine

C13H9Cl2FN2O3 (329.99742359999993)


   

5-[1-methyl-2-(3-methyl-2-thiazolidinylidene)ethylidene]-4-oxo- 2-thioxo-3- thiazolidineacetic acid

5-[1-methyl-2-(3-methyl-2-thiazolidinylidene)ethylidene]-4-oxo- 2-thioxo-3- thiazolidineacetic acid

C12H14N2O3S3 (330.0166534)


   
   

(6R)-7t-amino-8-oxo-3-[1,3,4]thiadiazol-2-ylsulfanylmethyl-(6rH)-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid

(6R)-7t-amino-8-oxo-3-[1,3,4]thiadiazol-2-ylsulfanylmethyl-(6rH)-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid

C10H10N4O3S3 (329.991503)


   

((2-bromo-5-methoxybenzyl)oxy)(tert-butyl)dimethylsilane

((2-bromo-5-methoxybenzyl)oxy)(tert-butyl)dimethylsilane

C14H23BrO2Si (330.0650598)


   

Uranyl(Ⅵ)carbonate

Uranyl(Ⅵ)carbonate

UO2CO3 (330.025361)


   

METHYL 4-BROMO-6-((TERT-BUTOXYCARBONYL)AMINO)PICOLINATE

METHYL 4-BROMO-6-((TERT-BUTOXYCARBONYL)AMINO)PICOLINATE

C12H15BrN2O4 (330.021513)


   

2-(6-BROMO-2-FLUORO-3-METHOXYPHENYL)-1,3,2-DIOXABOROLANE

2-(6-BROMO-2-FLUORO-3-METHOXYPHENYL)-1,3,2-DIOXABOROLANE

C13H17BBrFO3 (330.0438074)


   

2-(4-(Bromomethyl)-2-chlorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(4-(Bromomethyl)-2-chlorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C13H17BBrClO2 (330.01934220000004)


   

1,5-Dinitro-4,8-dihydroxyanthraquinone

1,5-Dinitro-4,8-dihydroxyanthraquinone

C14H6N2O8 (330.0124156)


   

3-(4-Bromophenyl)-5-(2-methoxyphenyl)-1,2,4-oxadiazole

3-(4-Bromophenyl)-5-(2-methoxyphenyl)-1,2,4-oxadiazole

C15H11BrN2O2 (330.00038459999996)


   

3-(4-Bromophenyl)-5-(4-methoxyphenyl)-1,2,4-oxadiazole

3-(4-Bromophenyl)-5-(4-methoxyphenyl)-1,2,4-oxadiazole

C15H11BrN2O2 (330.00038459999996)


   

(2-((2-Chloro-5-(trifluoromethyl)phenoxy)methyl)phenyl)boronic acid

(2-((2-Chloro-5-(trifluoromethyl)phenoxy)methyl)phenyl)boronic acid

C14H11BClF3O3 (330.0441832)


   
   

3-(1H-TETRAZOL-5-YL)-9H-THIOXANTHEN-9-O&

3-(1H-TETRAZOL-5-YL)-9H-THIOXANTHEN-9-O&

C14H10N4O4S (330.042274)


   

1,8-Dihydroxy-4,5-dinitroanthraquinone

1,8-Dihydroxy-4,5-dinitroanthraquinone

C14H6N2O8 (330.0124156)


   
   

bis(2,2,2-trifluoroethyl) phthalate

bis(2,2,2-trifluoroethyl) phthalate

C12H8F6O4 (330.032676)


   
   

Kermesic Acid

Kermesic Acid

C16H10O8 (330.037566)


A tetrahydroxyanthraquinone that is that is 3,5,6,8-tetrahydroxy-9,10-anthraquinone substituted by methyl and carboxy groups at positions 1 and 2 respectively. It is a natural dye isolated from the insect species Kermes ilices.

   

4-Chlorophenyl-[3-(trifluoromethyl)phenoxy]acetic acid

4-Chlorophenyl-[3-(trifluoromethyl)phenoxy]acetic acid

C15H10ClF3O3 (330.02705360000004)


   

cyathusal A

cyathusal A

C17H14O7 (330.0739494)


An organic heterotricyclic compound that is 1H,6H-pyrano[4,3-c]isochromene-7-carbaldehyde substituted by hydroxy groups at positions 9 and 10, methoxy group at position 8, oxo group at position 1 and a propenyl group at position 3. It is isolated from the fermented mushroom Cyathus stercoreus and exhibits radical scavenging activities.

   

Methyl 2-[4-(methylsulfonyl)phenyl]imidazo[1,2-a]pyridine-6-carboxylate

Methyl 2-[4-(methylsulfonyl)phenyl]imidazo[1,2-a]pyridine-6-carboxylate

C16H14N2O4S (330.06742440000005)


   
   
   

4-Chlorobenzoic acid (5-methyl-2-pyridin-4-yl-4-thiazolyl) ester

4-Chlorobenzoic acid (5-methyl-2-pyridin-4-yl-4-thiazolyl) ester

C16H11ClN2O2S (330.0229736)


   

1-[(2-Chlorophenyl)methyl]-2-oxo-6-(trifluoromethyl)-3-pyridinecarboxamide

1-[(2-Chlorophenyl)methyl]-2-oxo-6-(trifluoromethyl)-3-pyridinecarboxamide

C14H10ClF3N2O2 (330.0382866)


   

6-(4-chloro-2-fluoro-3-phenoxybenzyl)pyridazin-3(2H)-one

6-(4-chloro-2-fluoro-3-phenoxybenzyl)pyridazin-3(2H)-one

C17H12ClFN2O2 (330.05712939999995)


   

alpha-Ribazole-5-phosphate derivative

alpha-Ribazole-5-phosphate derivative

C12H15N2O7P (330.061685)


   
   

AIDS-071757

4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-methoxy- (9CI)

C17H14O7 (330.0739494)


   

CHEBI:37386

9,10-Anthracenedione, 1,3,7-trihydroxy-2,8-dimethoxy-6-methyl-

C17H14O7 (330.0739494)


Aurantio-obtusin is an anthraquinone isolated from Semen Cassiae, with anti-Inflammatory, anti-oxidative, anti-coagulating and anti-hypertension activities[1][2][3]. Aurantio-obtusin relaxes systemic arteries through endothelial PI3K/AKT/eNOS-dependent signaling pathway in rats, thus acts as a new potential vasodilator[2]. Aurantio-obtusin inhibits allergic responses in IgE-mediated mast cells and anaphylactic models and is potential for treatment for allergy-related diseases[3]. Aurantio-obtusin is an anthraquinone isolated from Semen Cassiae, with anti-Inflammatory, anti-oxidative, anti-coagulating and anti-hypertension activities[1][2][3]. Aurantio-obtusin relaxes systemic arteries through endothelial PI3K/AKT/eNOS-dependent signaling pathway in rats, thus acts as a new potential vasodilator[2]. Aurantio-obtusin inhibits allergic responses in IgE-mediated mast cells and anaphylactic models and is potential for treatment for allergy-related diseases[3].

   

AIDS-035388

4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-5-hydroxy-3,7-dimethoxy-

C17H14O7 (330.0739494)


   

3,5-Dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)chromen-7-one

3,5-Dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)chromen-7-one

C17H14O7 (330.0739494)


   

1,4,7-Trihydroxy-6,8-dimethoxy-2-methylanthraquinone

1,4,7-Trihydroxy-6,8-dimethoxy-2-methylanthraquinone

C17H14O7 (330.0739494)


   

3,5-Dihydroxy-1,2,4-trimethoxyanthracene-9,10-dione

3,5-Dihydroxy-1,2,4-trimethoxyanthracene-9,10-dione

C17H14O7 (330.0739494)


   

6-(5-carboxy-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

6-(5-carboxy-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C13H14O10 (330.05869440000004)


6-(5-carboxy-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid is a predicted metabolite generated by BioTransformer¹ that is produced by the metabolism of 3,4-dihydroxybenzoic acid. It is generated by UDP-glucuronosyltransferase 1-1 (P22309) enzyme via an aromatic-OH-glucuronidation reaction. This aromatic-OH-glucuronidation occurs in humans.

   
   
   

(3R)-5,7-dihydroxy-3-(6-methoxy-1,3-benzodioxol-5-yl)-2,3-dihydrochromen-4-one

(3R)-5,7-dihydroxy-3-(6-methoxy-1,3-benzodioxol-5-yl)-2,3-dihydrochromen-4-one

C17H14O7 (330.0739494)


   

2-(3,4-Dihydroxy-5-methoxyphenyl)-3-hydroxy-5-methoxychromen-7-one

2-(3,4-Dihydroxy-5-methoxyphenyl)-3-hydroxy-5-methoxychromen-7-one

C17H14O7 (330.0739494)


   
   

4-[(4-chlorobenzyl)amino]-3-nitro-2H-chromen-2-one

4-[(4-chlorobenzyl)amino]-3-nitro-2H-chromen-2-one

C16H11ClN2O4 (330.0407316)


   

(5E)-1-[(4-fluorophenyl)methyl]-5-(thiophen-2-ylmethylidene)-1,3-diazinane-2,4,6-trione

(5E)-1-[(4-fluorophenyl)methyl]-5-(thiophen-2-ylmethylidene)-1,3-diazinane-2,4,6-trione

C16H11FN2O3S (330.0474388)


   

3-amino-4,6-dimethyl-N-(2-thienylmethylene)thieno[2,3-b]pyridine-2-carbohydrazide

3-amino-4,6-dimethyl-N-(2-thienylmethylene)thieno[2,3-b]pyridine-2-carbohydrazide

C15H14N4OS2 (330.0608994)


   

N-[4-(6-chloro-5-nitro-1H-benzimidazol-2-yl)phenyl]acetamide

N-[4-(6-chloro-5-nitro-1H-benzimidazol-2-yl)phenyl]acetamide

C15H11ClN4O3 (330.0519646)


   

2-(4-fluorophenoxy)-N-(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)acetamide

2-(4-fluorophenoxy)-N-(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)acetamide

C15H11FN4O2S (330.0586718)


   

3-(2-fluorophenyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxylic acid methyl ester

3-(2-fluorophenyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxylic acid methyl ester

C16H11FN2O3S (330.0474388)


   

N-[3-(1,3-benzothiazol-2-yl)-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl]acetamide

N-[3-(1,3-benzothiazol-2-yl)-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl]acetamide

C16H14N2O2S2 (330.0496664)


   

N-propyl-N-(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)-2-thiophenecarboxamide

N-propyl-N-(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)-2-thiophenecarboxamide

C15H14N4OS2 (330.0608994)


   

N-[3-(2-chlorophenyl)-4-oxo-2-thiazolidinylidene]benzamide

N-[3-(2-chlorophenyl)-4-oxo-2-thiazolidinylidene]benzamide

C16H11ClN2O2S (330.0229736)


   

3-bromo-4-methoxy-N-(propan-2-ylcarbamothioyl)benzamide

3-bromo-4-methoxy-N-(propan-2-ylcarbamothioyl)benzamide

C12H15BrN2O2S (330.003755)


   

Calcium dihydrogen ethylenediaminetetraacetate

Calcium dihydrogen ethylenediaminetetraacetate

C10H14CaN2O8 (330.0376034)


   

5-[(4,7-dihydroxy-2-oxochromen-3-yl)carbamoyl]-1H-pyrrole-2-carboxylic acid

5-[(4,7-dihydroxy-2-oxochromen-3-yl)carbamoyl]-1H-pyrrole-2-carboxylic acid

C15H10N2O7 (330.04879900000003)


   
   

methyl 2-[(3S)-9,10-dihydroxy-7-methoxy-1-oxo-1H,3H,4H-naphtho[2,3-c]pyran-3-yl]acetate

methyl 2-[(3S)-9,10-dihydroxy-7-methoxy-1-oxo-1H,3H,4H-naphtho[2,3-c]pyran-3-yl]acetate

C17H14O7 (330.0739494)


   
   
   

(R)-(2,4-dichlorophenyl)(phenyl)pyrimidin-5-ylmethanol

(R)-(2,4-dichlorophenyl)(phenyl)pyrimidin-5-ylmethanol

C17H12Cl2N2O (330.0326642)


   

(S)-(2,4-dichlorophenyl)(phenyl)pyrimidin-5-ylmethanol

(S)-(2,4-dichlorophenyl)(phenyl)pyrimidin-5-ylmethanol

C17H12Cl2N2O (330.0326642)


   

N-carbamoyl-2-[(2E)-4-oxo-2-[(Z)-(2-oxo-1,3-thiazolidin-4-ylidene)hydrazinylidene]-1,3-thiazolidin-5-yl]acetamide

N-carbamoyl-2-[(2E)-4-oxo-2-[(Z)-(2-oxo-1,3-thiazolidin-4-ylidene)hydrazinylidene]-1,3-thiazolidin-5-yl]acetamide

C9H10N6O4S2 (330.02049400000004)


   

6-(2-Formyl-3,5-dihydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

6-(2-Formyl-3,5-dihydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C13H14O10 (330.05869440000004)


   

[2-Acetyloxy-3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxypropyl] acetate

[2-Acetyloxy-3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxypropyl] acetate

C10H19O10P (330.0715804)


   

Phosphoric acid bis(2-acetoxy-3-hydroxypropyl) ester

Phosphoric acid bis(2-acetoxy-3-hydroxypropyl) ester

C10H19O10P (330.0715804)


   

4-Bromo-6-hydroxy-7-methoxy-2-phenylcycloheptimidazole

4-Bromo-6-hydroxy-7-methoxy-2-phenylcycloheptimidazole

C15H11BrN2O2 (330.00038459999996)


   

4-[(3,3-Dimethoxy-4,7-dioxo-1,5-cycloheptadienyl)methyl]cyclohepta-3,6-diene-1,2,5-trione

4-[(3,3-Dimethoxy-4,7-dioxo-1,5-cycloheptadienyl)methyl]cyclohepta-3,6-diene-1,2,5-trione

C17H14O7 (330.0739494)


   

Aurantio-obtusin

1,3,7-TRIHYDROXY-2,8-DIMETHOXY-6-METHYL-9,10-DIHYDROANTHRACENE-9,10-DIONE

C17H14O7 (330.0739494)


Aurantio-obtusin is a trihydroxyanthraquinone that is 1,3,7-trihydroxy-9,10-anthraquinone which is by methoxy groups at positions 2 and 8, and by a methyl group at position 6. Aurantio-obtusin is a natural product found in Senna obtusifolia and Senna tora with data available. Aurantio-obtusin is an anthraquinone isolated from Semen Cassiae, with anti-Inflammatory, anti-oxidative, anti-coagulating and anti-hypertension activities[1][2][3]. Aurantio-obtusin relaxes systemic arteries through endothelial PI3K/AKT/eNOS-dependent signaling pathway in rats, thus acts as a new potential vasodilator[2]. Aurantio-obtusin inhibits allergic responses in IgE-mediated mast cells and anaphylactic models and is potential for treatment for allergy-related diseases[3]. Aurantio-obtusin is an anthraquinone isolated from Semen Cassiae, with anti-Inflammatory, anti-oxidative, anti-coagulating and anti-hypertension activities[1][2][3]. Aurantio-obtusin relaxes systemic arteries through endothelial PI3K/AKT/eNOS-dependent signaling pathway in rats, thus acts as a new potential vasodilator[2]. Aurantio-obtusin inhibits allergic responses in IgE-mediated mast cells and anaphylactic models and is potential for treatment for allergy-related diseases[3].

   

malathion

malathion

C10H19O6PS2 (330.0360644)


P - Antiparasitic products, insecticides and repellents > P03 - Ectoparasiticides, incl. scabicides, insecticides and repellents > P03A - Ectoparasiticides, incl. scabicides D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors D010575 - Pesticides > D007306 - Insecticides D004791 - Enzyme Inhibitors D016573 - Agrochemicals

   

pyrroloquinoline quinone

pyrroloquinoline quinone

C14H6N2O8 (330.0124156)


Pyrroloquinoline quinone (PQQ), a redox co-factor, is an anionic, redox-cycling orthoquinone. Pyrroloquinoline quinone is isolated from cultures of methylotropic bacteria and tissues of mammals. Pyrroloquinoline quinone is an essential nutrient for mammals and is important for immune function[1][2].

   

(+)-Bisdechlorogeodin

(+)-Bisdechlorogeodin

C17H14O7 (330.0739494)


   

Demethoxysudachitin

Demethoxysudachitin

C17H14O7 (330.0739494)


   

Mivotilate

Mivotilate

C12H14N2O3S3 (330.0166534)


C26170 - Protective Agent > C2081 - Hepatoprotective Agent

   

3,4-Di-O-methylellagic acid

3,4-Di-O-methylellagic acid

C16H10O8 (330.037566)


   
   

5,7-Dihydroxy-8,4-dimethoxyisoflavone

5,7-Dihydroxy-8,4-dimethoxyisoflavone

C17H14O7 (330.0739494)


   

3,4-Dihydroxybenzoic acid 3-O-beta-D-glucuronide

3,4-Dihydroxybenzoic acid 3-O-beta-D-glucuronide

C13H14O10 (330.05869440000004)


   

6-(4-carboxy-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

6-(4-carboxy-2-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C13H14O10 (330.05869440000004)


   

6-(4-carboxy-3-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

6-(4-carboxy-3-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C13H14O10 (330.05869440000004)


   

6-(3-carboxy-4-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

6-(3-carboxy-4-hydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C13H14O10 (330.05869440000004)


   

2-Deoxyinosine 5-phosphate(2-)

2-Deoxyinosine 5-phosphate(2-)

C10H11N4O7P (330.03653460000004)


A 2-deoxyribonucleoside 5-monophosphate(2-) obtained by deprotonation of the phosphate OH groups of 2-deoxyinosine 5-monophosphate; major species at pH 7.3.

   

cacibiocin A

cacibiocin A

C15H10N2O7 (330.04879900000003)


An aminocoumarin resulting from the formal condensation of one of the carboxy groups of pyrrole-2,5-dicarboxylic acid with the amino group of 3-amino-4,7-dihydroxycoumarin. It is a natural product isolated from Catenulispora acidiphila that doesnt exhibit an antimicrobial activity contrary to most aminocoumarins.

   
   
   

9,10-dihydroxy-8-methoxy-1-oxo-3-(prop-1-en-1-yl)-6h-pyrano[4,3-c]isochromene-7-carbaldehyde

9,10-dihydroxy-8-methoxy-1-oxo-3-(prop-1-en-1-yl)-6h-pyrano[4,3-c]isochromene-7-carbaldehyde

C17H14O7 (330.0739494)


   

methyl 4,8-dihydroxy-6-(2-hydroxyethyl)-9-oxoxanthene-3-carboxylate

methyl 4,8-dihydroxy-6-(2-hydroxyethyl)-9-oxoxanthene-3-carboxylate

C17H14O7 (330.0739494)


   

8,9,11-trimethoxy-2h-[1,3]dioxolo[4,5-b]xanthen-10-one

8,9,11-trimethoxy-2h-[1,3]dioxolo[4,5-b]xanthen-10-one

C17H14O7 (330.0739494)


   

7,8,9-trimethoxy-2h-[1,3]dioxolo[4,5-b]xanthen-10-one

7,8,9-trimethoxy-2h-[1,3]dioxolo[4,5-b]xanthen-10-one

C17H14O7 (330.0739494)


   

5,7,8-trihydroxy-2-methoxy-6-[(1e,3e)-5-oxohexa-1,3-dien-1-yl]naphthalene-1,4-dione

5,7,8-trihydroxy-2-methoxy-6-[(1e,3e)-5-oxohexa-1,3-dien-1-yl]naphthalene-1,4-dione

C17H14O7 (330.0739494)


   

(3e)-3-[(3,4-dihydroxyphenyl)methylidene]-5,8-dihydroxy-7-methoxy-2h-1-benzopyran-4-one

(3e)-3-[(3,4-dihydroxyphenyl)methylidene]-5,8-dihydroxy-7-methoxy-2h-1-benzopyran-4-one

C17H14O7 (330.0739494)


   

5,7-dihydroxy-3-(5-hydroxy-2,4-dimethoxyphenyl)chromen-4-one

5,7-dihydroxy-3-(5-hydroxy-2,4-dimethoxyphenyl)chromen-4-one

C17H14O7 (330.0739494)


   

3,5-dihydroxy-2-(4-hydroxyphenoxy)-7-methoxy-6-methylchromen-4-one

3,5-dihydroxy-2-(4-hydroxyphenoxy)-7-methoxy-6-methylchromen-4-one

C17H14O7 (330.0739494)


   

(2s,4z,7r,8s)-2-[(1r)-1-bromopropyl]-7-chloro-8-[(2e)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

(2s,4z,7r,8s)-2-[(1r)-1-bromopropyl]-7-chloro-8-[(2e)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

C15H20BrClO (330.03859600000004)


   

(2s,3s,8s)-8-[(1r)-1-bromopropyl]-3-chloro-2-[(2z)-pent-2-en-4-yn-1-yl]-3,4,7,8-tetrahydro-2h-oxocine

(2s,3s,8s)-8-[(1r)-1-bromopropyl]-3-chloro-2-[(2z)-pent-2-en-4-yn-1-yl]-3,4,7,8-tetrahydro-2h-oxocine

C15H20BrClO (330.03859600000004)


   

(2r,4z,7r,8r)-2-[(1r)-1-bromopropyl]-7-chloro-8-[(2e)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

(2r,4z,7r,8r)-2-[(1r)-1-bromopropyl]-7-chloro-8-[(2e)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

C15H20BrClO (330.03859600000004)


   

13,14-dihydroxy-6,7-dimethoxy-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4(16),5,7,11,13-hexaene-3,10-dione

13,14-dihydroxy-6,7-dimethoxy-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4(16),5,7,11,13-hexaene-3,10-dione

C16H10O8 (330.037566)


   

2,7-dihydroxy-6-(6-hydroxypurin-9-yl)-tetrahydro-4h-2λ⁵-furo[3,2-d][1,3,2]dioxaphosphinin-2-one

2,7-dihydroxy-6-(6-hydroxypurin-9-yl)-tetrahydro-4h-2λ⁵-furo[3,2-d][1,3,2]dioxaphosphinin-2-one

C10H11N4O7P (330.03653460000004)


   

(2s,3r,5z,8s,9s)-3-bromo-8-chloro-2-ethyl-9-[(2e)-pent-2-en-4-yn-1-yl]-2,3,4,7,8,9-hexahydrooxonine

(2s,3r,5z,8s,9s)-3-bromo-8-chloro-2-ethyl-9-[(2e)-pent-2-en-4-yn-1-yl]-2,3,4,7,8,9-hexahydrooxonine

C15H20BrClO (330.03859600000004)


   

(2r,3r,5s,6s,7r)-3,6,7-trihydroxy-2-(4-hydroxy-2-oxopyrimidin-1-yl)-hexahydro-2h-furo[3,2-b]pyran-5-carboxylic acid

(2r,3r,5s,6s,7r)-3,6,7-trihydroxy-2-(4-hydroxy-2-oxopyrimidin-1-yl)-hexahydro-2h-furo[3,2-b]pyran-5-carboxylic acid

C12H14N2O9 (330.0699274)


   

(2s,4z,7s,8s)-2-[(1r)-1-bromopropyl]-7-chloro-8-[(2z)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

(2s,4z,7s,8s)-2-[(1r)-1-bromopropyl]-7-chloro-8-[(2z)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

C15H20BrClO (330.03859600000004)


   

10-deactyltyunnanaxane

NA

C16H10O8 (330.037566)


{"Ingredient_id": "HBIN000098","Ingredient_name": "10-deactyltyunnanaxane","Alias": "NA","Ingredient_formula": "C16H10O8","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "26024","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2,2'-dimethoxy-3,3'-dihydroxy-5,5'-oxygen-6,6'-biphenylformic anhydride

2,2'-dimethoxy-3,3'-dihydroxy-5,5'-oxygen-6,6'-biphenylformicanhydride

C16H10O8 (330.037566)


{"Ingredient_id": "HBIN003698","Ingredient_name": "2,2'-dimethoxy-3,3'-dihydroxy-5,5'-oxygen-6,6'-biphenylformic anhydride","Alias": "2,2'-dimethoxy-3,3'-dihydroxy-5,5'-oxygen-6,6'-biphenylformicanhydride","Ingredient_formula": "C16H10O8","Ingredient_Smile": "COC1=C(C=C2C3=C1C(=O)OC(=O)C4=C3C(=CC(=C4OC)O)O2)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "30470;6219","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2,3-dimethoxyellagic acid

2,3-dimethoxyellagicacid

C16H10O8 (330.037566)


{"Ingredient_id": "HBIN004060","Ingredient_name": "2,3-dimethoxyellagic acid","Alias": "2,3-dimethoxyellagicacid","Ingredient_formula": "C16H10O8","Ingredient_Smile": "COC1=C(C2=C3C(=C1)C(=O)OC4=C3C(=CC(=C4O)O)C(=O)O2)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "30469;6223","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

3,4′-O-dimethylellagic acid

NA

C16H10O8 (330.037566)


{"Ingredient_id": "HBIN007509","Ingredient_name": "3,4\u2032-O-dimethylellagic acid","Alias": "NA","Ingredient_formula": "C16H10O8","Ingredient_Smile": "COC1=C(C2=C3C(=C1)C(=O)OC4=C3C(=CC(=C4OC)O)C(=O)O2)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41045","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

4,4′-di-O-methylellagic acid

NA

C16H10O8 (330.037566)


{"Ingredient_id": "HBIN009956","Ingredient_name": "4,4\u2032-di-O-methylellagic acid","Alias": "NA","Ingredient_formula": "C16H10O8","Ingredient_Smile": "COC1=C(C2=C3C(=C1)C(=O)OC4=C3C(=CC(=C4O)OC)C(=O)O2)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41094","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

3-bromo-5-chloro-2-ethyl-6-(octa-2,5-dien-7-yn-1-yl)oxane

3-bromo-5-chloro-2-ethyl-6-(octa-2,5-dien-7-yn-1-yl)oxane

C15H20BrClO (330.03859600000004)


   

8-(1-bromopropyl)-3-chloro-2-(pent-2-en-4-yn-1-yl)-3,4,7,8-tetrahydro-2h-oxocine

8-(1-bromopropyl)-3-chloro-2-(pent-2-en-4-yn-1-yl)-3,4,7,8-tetrahydro-2h-oxocine

C15H20BrClO (330.03859600000004)


   

(2r,3r,3as,5s,6s,7r,7ar)-2-(4-formyl-2-hydroxyimidazol-1-yl)-3,6,7-trihydroxy-hexahydro-2h-furo[3,2-b]pyran-5-carboxylic acid

(2r,3r,3as,5s,6s,7r,7ar)-2-(4-formyl-2-hydroxyimidazol-1-yl)-3,6,7-trihydroxy-hexahydro-2h-furo[3,2-b]pyran-5-carboxylic acid

C12H14N2O9 (330.0699274)


   

2,5-dihydroxy-6-(methoxycarbonyl)-9-oxoxanthene-4-carboxylic acid

2,5-dihydroxy-6-(methoxycarbonyl)-9-oxoxanthene-4-carboxylic acid

C16H10O8 (330.037566)


   

(2r,3s,5z,8s,9s)-3-bromo-8-chloro-2-ethyl-9-[(2e)-pent-2-en-4-yn-1-yl]-2,3,4,7,8,9-hexahydrooxonine

(2r,3s,5z,8s,9s)-3-bromo-8-chloro-2-ethyl-9-[(2e)-pent-2-en-4-yn-1-yl]-2,3,4,7,8,9-hexahydrooxonine

C15H20BrClO (330.03859600000004)


   

3-(bromomethyl)-7-[(3e)-1-chlorohex-3-en-5-yn-1-yl]-2-ethyl-2,3,6,7-tetrahydrooxepine

3-(bromomethyl)-7-[(3e)-1-chlorohex-3-en-5-yn-1-yl]-2-ethyl-2,3,6,7-tetrahydrooxepine

C15H20BrClO (330.03859600000004)


   

5-[(3e,6e)-1-bromonona-3,6-dien-8-yn-1-yl]-3-chloro-2-ethyloxolane

5-[(3e,6e)-1-bromonona-3,6-dien-8-yn-1-yl]-3-chloro-2-ethyloxolane

C15H20BrClO (330.03859600000004)


   

6,13-dihydroxy-7,14-dimethoxy-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione

6,13-dihydroxy-7,14-dimethoxy-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione

C16H10O8 (330.037566)


   

(2s,3r,5r,6r)-3-bromo-5-chloro-2-ethyl-6-[(2z,5e)-octa-2,5-dien-7-yn-1-yl]oxane

(2s,3r,5r,6r)-3-bromo-5-chloro-2-ethyl-6-[(2z,5e)-octa-2,5-dien-7-yn-1-yl]oxane

C15H20BrClO (330.03859600000004)


   

(2s,3r,5z,8r,9s)-3-bromo-8-chloro-2-ethyl-9-[(2z)-pent-2-en-4-yn-1-yl]-2,3,4,7,8,9-hexahydrooxonine

(2s,3r,5z,8r,9s)-3-bromo-8-chloro-2-ethyl-9-[(2z)-pent-2-en-4-yn-1-yl]-2,3,4,7,8,9-hexahydrooxonine

C15H20BrClO (330.03859600000004)


   

2-(1-bromopropyl)-7-[(3z)-1-chlorohex-3-en-5-yn-1-yl]-2,3,6,7-tetrahydrooxepine

2-(1-bromopropyl)-7-[(3z)-1-chlorohex-3-en-5-yn-1-yl]-2,3,6,7-tetrahydrooxepine

C15H20BrClO (330.03859600000004)


   

(2s,4z,7r,8r)-2-[(1s)-1-bromopropyl]-7-chloro-8-[(2e)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

(2s,4z,7r,8r)-2-[(1s)-1-bromopropyl]-7-chloro-8-[(2e)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

C15H20BrClO (330.03859600000004)


   

(2s,3s,8s)-8-[(1r)-1-bromopropyl]-3-chloro-2-[(2e)-pent-2-en-4-yn-1-yl]-3,4,7,8-tetrahydro-2h-oxocine

(2s,3s,8s)-8-[(1r)-1-bromopropyl]-3-chloro-2-[(2e)-pent-2-en-4-yn-1-yl]-3,4,7,8-tetrahydro-2h-oxocine

C15H20BrClO (330.03859600000004)


   

3-(bromomethyl)-7-(1-chlorohex-3-en-5-yn-1-yl)-2-ethyl-2,3,6,7-tetrahydrooxepine

3-(bromomethyl)-7-(1-chlorohex-3-en-5-yn-1-yl)-2-ethyl-2,3,6,7-tetrahydrooxepine

C15H20BrClO (330.03859600000004)


   

2-(1-bromopropyl)-7-(1-chlorohex-3-en-5-yn-1-yl)-2,3,6,7-tetrahydrooxepine

2-(1-bromopropyl)-7-(1-chlorohex-3-en-5-yn-1-yl)-2,3,6,7-tetrahydrooxepine

C15H20BrClO (330.03859600000004)


   

(2s,3s,5z,8r,9r)-3-bromo-8-chloro-2-ethyl-9-[(2z)-pent-2-en-4-yn-1-yl]-2,3,4,7,8,9-hexahydrooxonine

(2s,3s,5z,8r,9r)-3-bromo-8-chloro-2-ethyl-9-[(2z)-pent-2-en-4-yn-1-yl]-2,3,4,7,8,9-hexahydrooxonine

C15H20BrClO (330.03859600000004)


   

2-chloro-4-[5-(penta-1,3-diyn-1-yl)thiophen-2-yl]but-3-yn-1-yl 2-methylbut-2-enoate

2-chloro-4-[5-(penta-1,3-diyn-1-yl)thiophen-2-yl]but-3-yn-1-yl 2-methylbut-2-enoate

C18H15ClO2S (330.04812400000003)


   

4-({7-bromo-1h,2h,3h,4h,9h-pyrido[3,4-b]indol-1-yl}methyl)-3h-imidazole

4-({7-bromo-1h,2h,3h,4h,9h-pyrido[3,4-b]indol-1-yl}methyl)-3h-imidazole

C15H15BrN4 (330.048001)


   

(2r,4r)-4-[(4-bromopyrrol-2-ylidene)(oxido)methoxy]-2-carboxy-1,1-dimethylpyrrolidin-1-ium

(2r,4r)-4-[(4-bromopyrrol-2-ylidene)(oxido)methoxy]-2-carboxy-1,1-dimethylpyrrolidin-1-ium

C12H15BrN2O4 (330.021513)


   

(2r,3r,8r)-8-[(1r)-1-bromopropyl]-3-chloro-2-(pent-2-en-4-yn-1-yl)-3,4,7,8-tetrahydro-2h-oxocine

(2r,3r,8r)-8-[(1r)-1-bromopropyl]-3-chloro-2-(pent-2-en-4-yn-1-yl)-3,4,7,8-tetrahydro-2h-oxocine

C15H20BrClO (330.03859600000004)


   

(2r,4z,7r,8r)-2-[(1r)-1-bromopropyl]-7-chloro-8-[(2z)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

(2r,4z,7r,8r)-2-[(1r)-1-bromopropyl]-7-chloro-8-[(2z)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

C15H20BrClO (330.03859600000004)


   

(2s,3s,7r)-3-(bromomethyl)-7-[(1r,3z)-1-chlorohex-3-en-5-yn-1-yl]-2-ethyl-2,3,6,7-tetrahydrooxepine

(2s,3s,7r)-3-(bromomethyl)-7-[(1r,3z)-1-chlorohex-3-en-5-yn-1-yl]-2-ethyl-2,3,6,7-tetrahydrooxepine

C15H20BrClO (330.03859600000004)


   

(6s,8r,9r)-8-bromo-9-chloro-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-3-en-2-one

(6s,8r,9r)-8-bromo-9-chloro-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-3-en-2-one

C15H20BrClO (330.03859600000004)


   

(2s,4z,7s,8s)-2-[(1r)-1-bromopropyl]-7-chloro-8-[(2e)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

(2s,4z,7s,8s)-2-[(1r)-1-bromopropyl]-7-chloro-8-[(2e)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

C15H20BrClO (330.03859600000004)


   

6,12-dihydroxy-7,13-dimethoxy-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4(16),5,7,11,13-hexaene-3,10-dione

6,12-dihydroxy-7,13-dimethoxy-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4(16),5,7,11,13-hexaene-3,10-dione

C16H10O8 (330.037566)


   

3-bromo-8-chloro-2-ethyl-9-(pent-2-en-4-yn-1-yl)-2,3,4,7,8,9-hexahydrooxonine

3-bromo-8-chloro-2-ethyl-9-(pent-2-en-4-yn-1-yl)-2,3,4,7,8,9-hexahydrooxonine

C15H20BrClO (330.03859600000004)


   

4,7,9-trihydroxybenzo[j]fluoranthene-3,8-dione

4,7,9-trihydroxybenzo[j]fluoranthene-3,8-dione

C20H10O5 (330.052821)


   

2-(4-formyl-2-hydroxyimidazol-1-yl)-3,6,7-trihydroxy-hexahydro-2h-furo[3,2-b]pyran-5-carboxylic acid

2-(4-formyl-2-hydroxyimidazol-1-yl)-3,6,7-trihydroxy-hexahydro-2h-furo[3,2-b]pyran-5-carboxylic acid

C12H14N2O9 (330.0699274)


   

(6r,8s,9r)-8-bromo-9-chloro-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-3-en-2-one

(6r,8s,9r)-8-bromo-9-chloro-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-3-en-2-one

C15H20BrClO (330.03859600000004)


   

(2r,3r,3as,5s,6s,7r,7ar)-3,6,7-trihydroxy-2-(4-hydroxy-2-oxopyrimidin-1-yl)-hexahydro-2h-furo[3,2-b]pyran-5-carboxylic acid

(2r,3r,3as,5s,6s,7r,7ar)-3,6,7-trihydroxy-2-(4-hydroxy-2-oxopyrimidin-1-yl)-hexahydro-2h-furo[3,2-b]pyran-5-carboxylic acid

C12H14N2O9 (330.0699274)


   

(2r,3r,5r)-5-(1-bromopropyl)-3-chloro-2-[(2z,5e)-octa-2,5-dien-7-yn-1-yl]oxolane

(2r,3r,5r)-5-(1-bromopropyl)-3-chloro-2-[(2z,5e)-octa-2,5-dien-7-yn-1-yl]oxolane

C15H20BrClO (330.03859600000004)


   

1,5,6,8-tetrahydroxy-3-methyl-9,10-dioxoanthracene-2-carboxylic acid

1,5,6,8-tetrahydroxy-3-methyl-9,10-dioxoanthracene-2-carboxylic acid

C16H10O8 (330.037566)


   

(2r,3r,5r)-5-[(1r)-1-bromopropyl]-3-chloro-2-[(2z,5e)-octa-2,5-dien-7-yn-1-yl]oxolane

(2r,3r,5r)-5-[(1r)-1-bromopropyl]-3-chloro-2-[(2z,5e)-octa-2,5-dien-7-yn-1-yl]oxolane

C15H20BrClO (330.03859600000004)


   

(2s,3s,5z,8r,9r)-3-bromo-8-chloro-2-ethyl-9-[(2e)-pent-2-en-4-yn-1-yl]-2,3,4,7,8,9-hexahydrooxonine

(2s,3s,5z,8r,9r)-3-bromo-8-chloro-2-ethyl-9-[(2e)-pent-2-en-4-yn-1-yl]-2,3,4,7,8,9-hexahydrooxonine

C15H20BrClO (330.03859600000004)


   

5-(1-bromonona-3,6-dien-8-yn-1-yl)-3-chloro-2-ethyloxolane

5-(1-bromonona-3,6-dien-8-yn-1-yl)-3-chloro-2-ethyloxolane

C15H20BrClO (330.03859600000004)


   

(2r,4z,7s,8s)-2-[(1s)-1-bromopropyl]-7-chloro-8-[(2e)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

(2r,4z,7s,8s)-2-[(1s)-1-bromopropyl]-7-chloro-8-[(2e)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

C15H20BrClO (330.03859600000004)


   

(2r,3r,5r)-5-[(1s)-1-bromopropyl]-3-chloro-2-[(2z,5e)-octa-2,5-dien-7-yn-1-yl]oxolane

(2r,3r,5r)-5-[(1s)-1-bromopropyl]-3-chloro-2-[(2z,5e)-octa-2,5-dien-7-yn-1-yl]oxolane

C15H20BrClO (330.03859600000004)


   

(8s,9r)-8-bromo-9-chloro-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-3-en-2-one

(8s,9r)-8-bromo-9-chloro-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-3-en-2-one

C15H20BrClO (330.03859600000004)


   

1,7-dihydroxy-8-(methoxycarbonyl)-9-oxoxanthene-3-carboxylic acid

1,7-dihydroxy-8-(methoxycarbonyl)-9-oxoxanthene-3-carboxylic acid

C16H10O8 (330.037566)


   

3,6,7,8-tetrahydroxy-1-methyl-9,10-dioxoanthracene-2-carboxylic acid

3,6,7,8-tetrahydroxy-1-methyl-9,10-dioxoanthracene-2-carboxylic acid

C16H10O8 (330.037566)


   

(2s,3s,5s)-5-[(1r,3z,6z)-1-bromonona-3,6-dien-8-yn-1-yl]-3-chloro-2-ethyloxolane

(2s,3s,5s)-5-[(1r,3z,6z)-1-bromonona-3,6-dien-8-yn-1-yl]-3-chloro-2-ethyloxolane

C15H20BrClO (330.03859600000004)


   

(2r,3r,5s,6s,7r)-2-(4-formyl-2-hydroxyimidazol-1-yl)-3,6,7-trihydroxy-hexahydro-2h-furo[3,2-b]pyran-5-carboxylic acid

(2r,3r,5s,6s,7r)-2-(4-formyl-2-hydroxyimidazol-1-yl)-3,6,7-trihydroxy-hexahydro-2h-furo[3,2-b]pyran-5-carboxylic acid

C12H14N2O9 (330.0699274)


   

(2r,4z,7s,8r)-7-bromo-2-[(1r,3z)-1-chlorohex-3-en-5-yn-1-yl]-8-ethyl-3,6,7,8-tetrahydro-2h-oxocine

(2r,4z,7s,8r)-7-bromo-2-[(1r,3z)-1-chlorohex-3-en-5-yn-1-yl]-8-ethyl-3,6,7,8-tetrahydro-2h-oxocine

C15H20BrClO (330.03859600000004)


   

(2r,4z,7s,8r)-7-bromo-2-[(1r,3e)-1-chlorohex-3-en-5-yn-1-yl]-8-ethyl-3,6,7,8-tetrahydro-2h-oxocine

(2r,4z,7s,8r)-7-bromo-2-[(1r,3e)-1-chlorohex-3-en-5-yn-1-yl]-8-ethyl-3,6,7,8-tetrahydro-2h-oxocine

C15H20BrClO (330.03859600000004)


   

1-{7-bromo-9h-pyrido[3,4-b]indol-1-yl}-3-methylbutan-1-one

1-{7-bromo-9h-pyrido[3,4-b]indol-1-yl}-3-methylbutan-1-one

C16H15BrN2O (330.036768)


   

3-bromo-8-(1-chlorohex-3-en-5-yn-1-yl)-2-ethyl-3,4,7,8-tetrahydro-2h-oxocine

3-bromo-8-(1-chlorohex-3-en-5-yn-1-yl)-2-ethyl-3,4,7,8-tetrahydro-2h-oxocine

C15H20BrClO (330.03859600000004)


   

(2s,4z,7r,8s)-2-[(1r)-1-bromopropyl]-7-chloro-8-[(2z)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

(2s,4z,7r,8s)-2-[(1r)-1-bromopropyl]-7-chloro-8-[(2z)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

C15H20BrClO (330.03859600000004)


   

3,5,6,7-tetrahydroxy-1-methyl-9,10-dioxoanthracene-2-carboxylic acid

3,5,6,7-tetrahydroxy-1-methyl-9,10-dioxoanthracene-2-carboxylic acid

C16H10O8 (330.037566)


   

(2s,4z,7s,8s)-2-[(1s)-1-bromopropyl]-7-chloro-8-[(2e)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

(2s,4z,7s,8s)-2-[(1s)-1-bromopropyl]-7-chloro-8-[(2e)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

C15H20BrClO (330.03859600000004)


   

(2s,3r,5z,8s,9s)-3-bromo-8-chloro-2-ethyl-9-[(2z)-pent-2-en-4-yn-1-yl]-2,3,4,7,8,9-hexahydrooxonine

(2s,3r,5z,8s,9s)-3-bromo-8-chloro-2-ethyl-9-[(2z)-pent-2-en-4-yn-1-yl]-2,3,4,7,8,9-hexahydrooxonine

C15H20BrClO (330.03859600000004)


   

(2r,4z,7s,8s)-2-[(1s)-1-bromopropyl]-7-chloro-8-[(2z)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

(2r,4z,7s,8s)-2-[(1s)-1-bromopropyl]-7-chloro-8-[(2z)-pent-2-en-4-yn-1-yl]-3,6,7,8-tetrahydro-2h-oxocine

C15H20BrClO (330.03859600000004)


   

7,14-dihydroxy-6,13-dimethoxy-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4(16),5,7,11,13-hexaene-3,10-dione

7,14-dihydroxy-6,13-dimethoxy-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4(16),5,7,11,13-hexaene-3,10-dione

C16H10O8 (330.037566)


   

(2r,7r)-2-[(1r)-1-bromopropyl]-7-[(1r,3z)-1-chlorohex-3-en-5-yn-1-yl]-2,3,6,7-tetrahydrooxepine

(2r,7r)-2-[(1r)-1-bromopropyl]-7-[(1r,3z)-1-chlorohex-3-en-5-yn-1-yl]-2,3,6,7-tetrahydrooxepine

C15H20BrClO (330.03859600000004)


   

(2s)-2-chloro-4-[5-(penta-1,3-diyn-1-yl)thiophen-2-yl]but-3-yn-1-yl (2z)-2-methylbut-2-enoate

(2s)-2-chloro-4-[5-(penta-1,3-diyn-1-yl)thiophen-2-yl]but-3-yn-1-yl (2z)-2-methylbut-2-enoate

C18H15ClO2S (330.04812400000003)


   

(2r,3s,5z,8s,9s)-3-bromo-8-chloro-2-ethyl-9-[(2z)-pent-2-en-4-yn-1-yl]-2,3,4,7,8,9-hexahydrooxonine

(2r,3s,5z,8s,9s)-3-bromo-8-chloro-2-ethyl-9-[(2z)-pent-2-en-4-yn-1-yl]-2,3,4,7,8,9-hexahydrooxonine

C15H20BrClO (330.03859600000004)


   

8-bromo-9-chloro-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-3-en-2-one

8-bromo-9-chloro-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-3-en-2-one

C15H20BrClO (330.03859600000004)