Exact Mass: 322.03788399999996

Exact Mass Matches: 322.03788399999996

Found 278 metabolites which its exact mass value is equals to given mass value 322.03788399999996, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Thymidine-5'-monophosphoric acid

{[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methoxy}phosphonic acid

C10H15N2O8P (322.0566)


5-Thymidylic acid (conjugate base thymidylate), also known as thymidine monophosphate (TMP), deoxythymidine monophosphate (dTMP), or deoxythymidylic acid (conjugate base deoxythymidylate), is a nucleotide that is used as a monomer in DNA. It is an ester of phosphoric acid with the nucleoside thymidine. dTMP consists of a phosphate group, the pentose sugar deoxyribose, and the nucleobase thymine. Unlike the other deoxyribonucleotides, thymidine monophosphate often does not contain the "deoxy" prefix in its name; nevertheless, its symbol often includes a "d" ("dTMP"). 5-Thymidylic acid belongs to the class of organic compounds known as pyrimidine 2-deoxyribonucleoside monophosphates. These are pyrimidine nucleotides with a monophosphate group linked to the ribose moiety lacking a hydroxyl group at position 2. The neutral species of 5-Thymidylic acid (2-deoxythymidine 5-monophosphate). 5-Thymidylic acid exists in all living species, ranging from bacteria to humans. Within humans, 5-thymidylic acid participates in a number of enzymatic reactions. In particular, 5-thymidylic acid and dihydrofolic acid can be biosynthesized from dUMP and 5,10-methylene-THF by the enzyme thymidylate synthase. In addition, 5-thymidylic acid can be converted into dTDP; which is catalyzed by the enzyme thymidylate synthase. In humans, 5-thymidylic acid is involved in pyrimidine metabolism. Outside of the human body, 5-Thymidylic acid has been detected, but not quantified in several different foods, such as common buckwheats, corn salad, garden cress, squashberries, and star fruits. 5-thymidylic acid, also known as thymidylate or thymidine 5-phosphate, is a member of the class of compounds known as pyrimidine 2-deoxyribonucleoside monophosphates. Pyrimidine 2-deoxyribonucleoside monophosphates are pyrimidine nucleotides with a monophosphate group linked to the ribose moiety lacking a hydroxyl group at position 2. 5-thymidylic acid is slightly soluble (in water) and a moderately acidic compound (based on its pKa). 5-thymidylic acid can be found in a number of food items such as burbot, enokitake, scarlet bean, and garland chrysanthemum, which makes 5-thymidylic acid a potential biomarker for the consumption of these food products. 5-thymidylic acid can be found primarily in feces, as well as in human fibroblasts tissue. 5-thymidylic acid exists in all living species, ranging from bacteria to humans. In humans, 5-thymidylic acid is involved in the pyrimidine metabolism. 5-thymidylic acid is also involved in few metabolic disorders, which include beta ureidopropionase deficiency, dihydropyrimidinase deficiency, MNGIE (mitochondrial neurogastrointestinal encephalopathy), and UMP synthase deficiency (orotic aciduria). Acquisition and generation of the data is financially supported in part by CREST/JST.

   

Chloramphenicol

D-(-)-2,2-Dichloro-N-(beta-hydroxy-alpha-(hydroxymethyl)-p-nitrophenylethyl)acetamide

C11H12Cl2N2O5 (322.0123242)


An antibiotic first isolated from cultures of Streptomyces venequelae in 1947 but now produced synthetically. It has a relatively simple structure and was the first broad-spectrum antibiotic to be discovered. It acts by interfering with bacterial protein synthesis and is mainly bacteriostatic. (From Martindale, The Extra Pharmacopoeia, 29th ed, p106) G - Genito urinary system and sex hormones > G01 - Gynecological antiinfectives and antiseptics > G01A - Antiinfectives and antiseptics, excl. combinations with corticosteroids > G01AA - Antibiotics D - Dermatologicals > D10 - Anti-acne preparations > D10A - Anti-acne preparations for topical use > D10AF - Antiinfectives for treatment of acne D - Dermatologicals > D06 - Antibiotics and chemotherapeutics for dermatological use > D06A - Antibiotics for topical use S - Sensory organs > S03 - Ophthalmological and otological preparations > S03A - Antiinfectives > S03AA - Antiinfectives J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01B - Amphenicols > J01BA - Amphenicols S - Sensory organs > S01 - Ophthalmologicals > S01A - Antiinfectives > S01AA - Antibiotics S - Sensory organs > S02 - Otologicals > S02A - Antiinfectives > S02AA - Antiinfectives D004791 - Enzyme Inhibitors > D011500 - Protein Synthesis Inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents CONFIDENCE standard compound; EAWAG_UCHEM_ID 3070 C254 - Anti-Infective Agent > C258 - Antibiotic C784 - Protein Synthesis Inhibitor KEIO_ID C057; [MS3] KO008919 KEIO_ID C057; [MS2] KO008918 KEIO_ID C057

   

Sulprofos

Ethoxy-(4-methylsulphanylphenoxy)-propylsulphanyl-sulphanylidene-$l^{5}-phosphane

C12H19O2PS3 (322.0284764)


C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor

   

digallate

Benzoic acid,3,4-dihydroxy-5-[(3,4,5-trihydroxybenzoyl)oxy]-

C14H10O9 (322.032481)


D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors

   

Leukoefdin

2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,4,5,7-tetrol

C15H14O8 (322.0688644)


Flavan-3,3',4,4',5,5',7-heptol is a flavanol that is 3,4-dihydro-2H-chromene which is substituted at positions 3, 4, 5, and 7 by hydroxy groups, and at position 2 by a 3,4,5-trihydroxyphenyl group. It is a hydroxyflavan, a member of catechols, a glycol, a member of resorcinols, a secondary alcohol and a polyphenol. Leucodelphinidin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=491-52-1 (retrieved 2024-07-12) (CAS RN: 491-52-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

   

Decarboxytetracenomycin F1

Decarboxytetracenomycin F1

C19H14O5 (322.0841194)


   

Tetrangomycin

Tetrangomycin

C19H14O5 (322.0841194)


An angucycline antibiotic that is 3,4-dihydrotetraphene-1,7,12(2H)-trione substituted by hydroxy groups at positions 3 and 8 and a methyl group at position 3 (the 3R stereoisomer) ring system. It is an antibiotic isolated from Streptomyces sp.

   

11-Deoxylandomycinone

11-Deoxylandomycinone

C19H14O5 (322.0841194)


   

Sulfotep

Diethoxy-[ethoxy(methoxymethyl)phosphinothioyl]oxy-sulfanylidene-lambda5-phosphane

C8H20O5P2S2 (322.022737)


C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor

   

Minodronic acid

Minodronic acid

C9H12N2O7P2 (322.0119742)


C78281 - Agent Affecting Musculoskeletal System > C67439 - Bone Resorption Inhibitor D050071 - Bone Density Conservation Agents > D004164 - Diphosphonates Minodronic acid (YM-529) is a third-generation bisphosphonate that directly and indirectly prevents proliferation, induces apoptosis, and inhibits metastasis of various types of cancer cells. Minodronic acid (YM-529) is an antagonist of purinergic P2X2/3 receptors involved in pain[1][2].

   

L-gamma-Glutamyl-S-allylthio-L-cysteine

2-Amino-4-{[1-carboxy-2-(prop-2-en-1-yldisulphanyl)ethyl]-C-hydroxycarbonimidoyl}butanoic acid

C11H18N2O5S2 (322.0657098)


N-gamma-Glutamyl-S-(allylthio)cysteine is found in onion-family vegetables. N-gamma-Glutamyl-S-(allylthio)cysteine is a constituent of garlic (Allium sativum). Constituent of garlic (Allium sativum). L-gamma-Glutamyl-S-allylthio-L-cysteine is found in garlic, soft-necked garlic, and onion-family vegetables.

   

7,7'-Dihydroxy-6,8'-bicoumarin

7-hydroxy-6-(7-hydroxy-2-oxo-2H-chromen-8-yl)-2H-chromen-2-one

C18H10O6 (322.047736)


7,7-Dihydroxy-6,8-bicoumarin is found in herbs and spices. 7,7-Dihydroxy-6,8-bicoumarin is isolated from white clover (Trifolium repens). Isolated from white clover (Trifolium repens). 7,7-Dihydroxy-6,8-bicoumarin is found in tea, herbs and spices, and pulses.

   

4-(3,4-Dihydroxyphenyl)-2,3-dihydro-2,3-dihydroxy-1H-phenalen-1-one

4-(3,4-dihydroxyphenyl)-2,3-dihydroxy-2,3-dihydro-1H-phenalen-1-one

C19H14O5 (322.0841194)


4-(3,4-Dihydroxyphenyl)-2,3-dihydro-2,3-dihydroxy-1H-phenalen-1-one is found in fruits. 4-(3,4-Dihydroxyphenyl)-2,3-dihydro-2,3-dihydroxy-1H-phenalen-1-one is a constituent of Musa acuminata (dwarf banana) infected with Colletotrichum musae. Constituent of Musa acuminata (dwarf banana) infected with Colletotrichum musae. 4-(3,4-Dihydroxyphenyl)-2,3-dihydro-2,3-dihydroxy-1H-phenalen-1-one is found in fruits.

   

thymidine 3'-monophosphate

{[5-(4-hydroxy-5-methyl-2-oxo-1,2-dihydropyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy}phosphonic acid

C10H15N2O8P (322.0566)


thymidine 3-monophosphate is considered to be soluble (in water) and acidic

   

N-[4-[(6-Methoxypyrimidin-4-yl)sulfamoyl]phenyl]acetamide

N-[4-[(6-Methoxypyrimidin-4-yl)sulphamoyl]phenyl]acetamide

C13H14N4O4S (322.07357240000005)


D000890 - Anti-Infective Agents > D013424 - Sulfanilamides

   

Dextramycin

2,2-Dichloro-N-[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]ethanimidate

C11H12Cl2N2O5 (322.0123242)


   

Minodronic acid

(1-Hydroxy-2-(imidazo(1,2-a)-pyridin-3-yl)ethylidene)bisphosphonic acid monohydrate

C9H12N2O7P2 (322.0119742)


C78281 - Agent Affecting Musculoskeletal System > C67439 - Bone Resorption Inhibitor D050071 - Bone Density Conservation Agents > D004164 - Diphosphonates Minodronic acid (YM-529) is a third-generation bisphosphonate that directly and indirectly prevents proliferation, induces apoptosis, and inhibits metastasis of various types of cancer cells. Minodronic acid (YM-529) is an antagonist of purinergic P2X2/3 receptors involved in pain[1][2].

   

N-(6-Chloro-9h-pyrido[3,4-b]indol-8-yl)-3-pyridinecarboxamide

N-{6-chloro-9H-pyrido[3,4-b]indol-8-yl}pyridine-3-carboximidate

C17H11ClN4O (322.0621346)


   

Sulfotep

O,O-diethyl {[diethoxy(sulfanylidene)-λ⁵-phosphanyl]oxy}phosphonothioate

C8H20O5P2S2 (322.022737)


C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor

   

Trofosfamide

2-[bis(2-chloroethyl)amino]-3-(2-chloroethyl)-1,3,2lambda5-oxazaphosphinan-2-one

C9H18Cl3N2O2P (322.01714280000004)


L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01A - Alkylating agents > L01AA - Nitrogen mustard analogues D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D009588 - Nitrogen Mustard Compounds D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D010752 - Phosphoramide Mustards C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D009676 - Noxae > D000477 - Alkylating Agents D009676 - Noxae > D009153 - Mutagens

   

Saxalin

4-(3-chloro-2-hydroxy-3-methylbutoxy)-7H-furo[3,2-g]chromen-7-one

C16H15ClO5 (322.060797)


Saxalin is a member of the class of compounds known as psoralens. Psoralens are organic compounds containing a psoralen moiety, which consists of a furan fused to a chromenone to for 7H-furo[3,2-g]chromen-7-one. Saxalin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Saxalin can be found in parsley, which makes saxalin a potential biomarker for the consumption of this food product.

   

Sodium sulfate decahydrate

Disodium sulphuric acid decahydric acid

H20Na2O14S (322.036914)


Added to food as a flavour or flavour-modifier, pH control agent or clarifying/flocculating agent

   

Dulcisflavan

(2R,3R)-2-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,6,7,8-pentol

C15H14O8 (322.0688644)


   

cyanidin

1-benzopyrylium, 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-, chloride (1:1)

C15H11ClO6 (322.0244136)


See also: Bilberry (part of). Cyanidin Chloride (IdB 1027), a subclass of anthocyanin, displays antioxidant and anti-carcinogenesis properties. Cyanidin Chloride (IdB 1027) inhibits osteoclast formation, hydroxyapatite resorption, and receptor activator of NF-κB ligand (RANKL)-induced osteoclast marker gene expression[1]. Cyanidin Chloride (IdB 1027), a subclass of anthocyanin, displays antioxidant and anti-carcinogenesis properties. Cyanidin Chloride (IdB 1027) inhibits osteoclast formation, hydroxyapatite resorption, and receptor activator of NF-κB ligand (RANKL)-induced osteoclast marker gene expression[1].

   

vulpinic acid

vulpinic acid

C19H14O5 (322.0841194)


Vulpinic acid, a lichen metabolite, decreases H2O2-induced ROS production, oxidative stress and oxidative stress-related damages in human umbilical vein endothelial cells (HUVEC). Vulpinic acid is active against staphylococci, enterococci, and anaerobic bacteria.Vulpinic acid has?the?potential?for?atherosclerosis?research[1][2].

   
   

2,7,8-Trihydroxy-3-phenyl-1,4-dibenzofurandione

2,7,8-Trihydroxy-3-phenyl-1,4-dibenzofurandione

C18H10O6 (322.047736)


   

3-methoxy-2-(3-methoxyphenyl)furo[2,3-h]chromen-4-one

3-methoxy-2-(3-methoxyphenyl)furo[2,3-h]chromen-4-one

C19H14O5 (322.0841194)


   

3,6-Dimethoxyfurano[4,5:8,7]flavone

3,6-Dimethoxyfurano[4,5:8,7]flavone

C19H14O5 (322.0841194)


   
   

Isosaxalin

(+)-8-(3-Chloro-2-hydroxy-3-methylbutoxy)psoralen

C16H15ClO5 (322.060797)


   

-)-Altenuic acid II

-)-Altenuic acid II

C15H14O8 (322.0688644)


   

Elephantorrhizol

(2R,3S) -2- (3,4-Dihydroxyphenyl) -3,4-dihydro-2H-1-benzopyran-3,5,6,7,8-pentol

C15H14O8 (322.0688644)


   

Crotafuran B

(6aR,11aR)-5-Acetyl-3-hydroxyfurano[2,3:9,10]pterocarpan

C19H14O5 (322.0841194)


   
   
   
   

7,7-Dihydroxy-3,8-biscoumarin

7,7-Dihydroxy-3,8-biscoumarin

C18H10O6 (322.047736)


   

Millettocalyxin C

2- (2,5-Dimethoxyphenyl) -4H-furo [ 2,3-h ] -1-benzopyran-4-one

C19H14O5 (322.0841194)


   

Leuco-delphinidin

3,4,5,7,3,4,5-Heptahydroxyflavan

C15H14O8 (322.0688644)


   

3,4-Dimethoxyfurano[2,3:7,8]flavone

3,4-Dimethoxyfurano [ 2,3:7,8 ] flavone

C19H14O5 (322.0841194)


   

2-(2-Furylcarbonyl)-3-[4-(trifluoromethoxy)anilino]acrylonitrile

2-(2-Furylcarbonyl)-3-[4-(trifluoromethoxy)anilino]acrylonitrile

C15H9F3N2O3 (322.05652399999997)


   
   
   

2-(3,5-dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester

2-(3,5-dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester

C19H14O5 (322.0841194)


   

4-methoxy-5-(3,4-methylenedioxycinnamoyl) benzofuran

4-methoxy-5-(3,4-methylenedioxycinnamoyl) benzofuran

C19H14O5 (322.0841194)


   

16-bromo-(7E,15E)-hexadeca-7,15-dien-5,13-diynoic acid

16-bromo-(7E,15E)-hexadeca-7,15-dien-5,13-diynoic acid

C16H19BrO2 (322.05683339999996)


   

O-Methylfulvic acid

O-Methylfulvic acid

C15H14O8 (322.0688644)


   

3,4-dimethoxy(2,3:7,8)furanoflavone

3,4-dimethoxy(2,3:7,8)furanoflavone

C19H14O5 (322.0841194)


   

3,6-Dihydroxy-5-methoxy-7-phenyl-1H,3H-naphtho[1,8-cd]pyran-1-one

3,6-Dihydroxy-5-methoxy-7-phenyl-1H,3H-naphtho[1,8-cd]pyran-1-one

C19H14O5 (322.0841194)


   

2-Isoprenylemodin

2-Isoprenylemodin

C19H14O5 (322.0841194)


   
   

2,7,8-Trihydroxy-3-phenyldibenzofuran-1,4-dione

2,7,8-Trihydroxy-3-phenyldibenzofuran-1,4-dione

C18H10O6 (322.047736)


   
   

3,6-Dimethoxy-2-phenyl-4H-furo[2,3-h]-1-benzopyran-4-one

3,6-Dimethoxy-2-phenyl-4H-furo[2,3-h]-1-benzopyran-4-one

C19H14O5 (322.0841194)


   

(9E,15E)-form-16-Bromo-9,15-hexadecadiene-5,7-diynoic acid

(9E,15E)-form-16-Bromo-9,15-hexadecadiene-5,7-diynoic acid

C16H19BrO2 (322.05683339999996)


   

(+)-(2S,3R,1S,6R)-5,7-dihydroxy-3,6-epoxy-1,2,3,4,5,6-tetrahydro-3,4-secoflava-4,1-lactone-3-oic acid

(+)-(2S,3R,1S,6R)-5,7-dihydroxy-3,6-epoxy-1,2,3,4,5,6-tetrahydro-3,4-secoflava-4,1-lactone-3-oic acid

C15H14O8 (322.0688644)


   

6,3-dimethoxy-[2,3:7,8]furanoflavone

6,3-dimethoxy-[2,3:7,8]furanoflavone

C19H14O5 (322.0841194)


   
   

1-(3,4,5-Trihydroxyphenyl)-2-hydroxy-3-(2,4,6-trihydroxyphenyl)propane-1-one

1-(3,4,5-Trihydroxyphenyl)-2-hydroxy-3-(2,4,6-trihydroxyphenyl)propane-1-one

C15H14O8 (322.0688644)


   
   

(E)-5-(2-formylvinyl)-7-methoxy-2-(3,4-methylenedioxyphenyl)benzofuran

(E)-5-(2-formylvinyl)-7-methoxy-2-(3,4-methylenedioxyphenyl)benzofuran

C19H14O5 (322.0841194)


   
   
   

(+/-)-Altenuic acid II

(+/-)-Altenuic acid II

C15H14O8 (322.0688644)


   

(2R,3R,4R)-2-(4-carboxymethyl-gamma-butenolide-3-yl)-3,5,7-trihydroxychroman|viniferone C

(2R,3R,4R)-2-(4-carboxymethyl-gamma-butenolide-3-yl)-3,5,7-trihydroxychroman|viniferone C

C15H14O8 (322.0688644)


   

ClC(C(C=C(C=CC=CC=CC(CC)C)O)=O)(Cl)Cl

ClC(C(C=C(C=CC=CC=CC(CC)C)O)=O)(Cl)Cl

C14H17Cl3O2 (322.02940720000004)


   

(2S)-7,9-dihydroxy-2-(prop-1-en-2-yl)-1,2-dihydroanthra[2,1-b]furan-6,11-dione

(2S)-7,9-dihydroxy-2-(prop-1-en-2-yl)-1,2-dihydroanthra[2,1-b]furan-6,11-dione

C19H14O5 (322.0841194)


   
   

8-hydroxy-7,7-oxydicoumarin

8-hydroxy-7,7-oxydicoumarin

C18H10O6 (322.047736)


   
   

6-(Sulfooxy)-9H-pyrido[3,4-b]indole-3-carboxylic acid 3-methyl ester

6-(Sulfooxy)-9H-pyrido[3,4-b]indole-3-carboxylic acid 3-methyl ester

C13H10N2O6S (322.02595600000006)


   

7,5-dihydroxy-3,6-bicoumarinyl

7,5-dihydroxy-3,6-bicoumarinyl

C18H10O6 (322.047736)


   

Dictyoterphenyl B

Dictyoterphenyl B

C19H14O5 (322.0841194)


   

2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,6,7,8-pentol

2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,6,7,8-pentol

C15H14O8 (322.0688644)


   

3,3a-Dihydro-3a-hydroxy-5-methoxy-7-phenyl-1H,6H-naphtho[1,8-cd]pyran-1,6-dione

3,3a-Dihydro-3a-hydroxy-5-methoxy-7-phenyl-1H,6H-naphtho[1,8-cd]pyran-1,6-dione

C19H14O5 (322.0841194)


   
   

3,4-methylenedioxy-[2,3:7,8]furanoflavonol

3,4-methylenedioxy-[2,3:7,8]furanoflavonol

C18H10O6 (322.047736)


   
   
   
   

Saxalin

7H-Furo(3,2-g)(1)benzopyran-7-one, 4-(3-chloro-2-hydroxy-3-methylbutoxy)-

C16H15ClO5 (322.060797)


Saxalin is a natural product found in Harbouria trachypleura, Petroselinum crispum, and other organisms with data available.

   
   
   

7,7-Dihydroxy-3,8-biscoumain

7,7-Dihydroxy-3,8-biscoumain

C18H10O6 (322.047736)


   

(3R)-3-chloro-6-hydroxy-8-methoxy-alpha-lapachone|(R)-3-chloro-6-hydroxy-8-methoxy-alpha-lapachone

(3R)-3-chloro-6-hydroxy-8-methoxy-alpha-lapachone|(R)-3-chloro-6-hydroxy-8-methoxy-alpha-lapachone

C16H15ClO5 (322.060797)


   
   
   

SAXAKIN

(+)-9-(3-Chloro-2-hydroxy-3-methylbutoxy)-7H-furo[3,2-g][1]benzopyran-7-one; 8-(3-Chloro-2-hydroxy-3-methylbutoxy)psoralen; 8-(3-Chloro-2-hydroxy-3-methylbutyloxy)psoralen

C16H15ClO5 (322.060797)


   

chloramphenicol

2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]acetamide

C11H12Cl2N2O5 (322.0123242)


G - Genito urinary system and sex hormones > G01 - Gynecological antiinfectives and antiseptics > G01A - Antiinfectives and antiseptics, excl. combinations with corticosteroids > G01AA - Antibiotics D - Dermatologicals > D10 - Anti-acne preparations > D10A - Anti-acne preparations for topical use > D10AF - Antiinfectives for treatment of acne An organochlorine compound that is dichloro-substituted acetamide containing a nitrobenzene ring, an amide bond and two alcohol functions. D - Dermatologicals > D06 - Antibiotics and chemotherapeutics for dermatological use > D06A - Antibiotics for topical use S - Sensory organs > S03 - Ophthalmological and otological preparations > S03A - Antiinfectives > S03AA - Antiinfectives J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01B - Amphenicols > J01BA - Amphenicols S - Sensory organs > S01 - Ophthalmologicals > S01A - Antiinfectives > S01AA - Antibiotics S - Sensory organs > S02 - Otologicals > S02A - Antiinfectives > S02AA - Antiinfectives D004791 - Enzyme Inhibitors > D011500 - Protein Synthesis Inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents C254 - Anti-Infective Agent > C258 - Antibiotic C784 - Protein Synthesis Inhibitor CONFIDENCE standard compound; INTERNAL_ID 662; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3461; ORIGINAL_PRECURSOR_SCAN_NO 3459 CONFIDENCE standard compound; INTERNAL_ID 662; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3476; ORIGINAL_PRECURSOR_SCAN_NO 3473 CONFIDENCE standard compound; INTERNAL_ID 662; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3449; ORIGINAL_PRECURSOR_SCAN_NO 3445 CONFIDENCE standard compound; INTERNAL_ID 662; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3469; ORIGINAL_PRECURSOR_SCAN_NO 3467 CONFIDENCE standard compound; INTERNAL_ID 662; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3457; ORIGINAL_PRECURSOR_SCAN_NO 3455 CONFIDENCE standard compound; INTERNAL_ID 662; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3458; ORIGINAL_PRECURSOR_SCAN_NO 3457 Origin: Microbe, Propylene glycols, Nitrobenzenes CONFIDENCE standard compound; INTERNAL_ID 2306 CONFIDENCE standard compound; INTERNAL_ID 8318 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.577 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.575 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.573 CONFIDENCE standard compound; INTERNAL_ID 4073

   

5-Thymidylic acid

Thymidine-5-monophosphate

C10H15N2O8P (322.0566)


   

THYMIDINE 5-MONOPHOSPHATE

THYMIDINE 5-MONOPHOSPHATE

C10H15N2O8P (322.0566)


   

methyl 3,7,8-trihydroxy-3-methyl-10-oxo-1,4-dihydropyrano[4,3-b]chromene-9-carboxylate

NCGC00380791-01!methyl 3,7,8-trihydroxy-3-methyl-10-oxo-1,4-dihydropyrano[4,3-b]chromene-9-carboxylate

C15H14O8 (322.0688644)


   

3,8-dihydroxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione

NCGC00180837-02!3,8-dihydroxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione

C19H14O5 (322.0841194)


   

Thymidine 5-monophosphate

Thymidine 5-monophosphate

C10H15N2O8P (322.0566)


   

dTMP

dTMP

C10H15N2O8P (322.0566)


The neutral species of thymidine 5-monophosphate (2-deoxythymidine 5-monophosphate).

   

3,8-dihydroxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione [IIN-based: Match]

NCGC00180837-02!3,8-dihydroxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione [IIN-based: Match]

C19H14O5 (322.0841194)


   

3,8-dihydroxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione [IIN-based on: CCMSLIB00000847997]

NCGC00180837-02!3,8-dihydroxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione [IIN-based on: CCMSLIB00000847997]

C19H14O5 (322.0841194)


   

THYMIDINE 5'-MONOPHOSPHATE

THYMIDINE 5'-MONOPHOSPHATE

C10H15N2O8P (322.0566)


   

THYMIDINE-MONOPHOSPHATE

THYMIDINE-MONOPHOSPHATE

C10H15N2O8P (322.0566)


   
   
   

7,7'-Dihydroxy-6,8'-bicoumarin

7-hydroxy-8-(7-hydroxy-2-oxo-2H-chromen-6-yl)-2H-chromen-2-one

C18H10O6 (322.047736)


   

4-(3,4-dihydroxyphenyl)-2,3-dihydroxy-2,3-dihydro-1H-phenalen-1-one

4-(3,4-dihydroxyphenyl)-2,3-dihydroxy-2,3-dihydro-1H-phenalen-1-one

C19H14O5 (322.0841194)


   

L-gamma-Glutamyl-S-allylthio-L-cysteine

2-amino-4-{[1-carboxy-2-(prop-2-en-1-yldisulfanyl)ethyl]carbamoyl}butanoic acid

C11H18N2O5S2 (322.0657098)


   

GN25

GN25

C15H14O6S (322.05110640000004)


GN25 is a specific p53-Snail binding inhibitor with antitumor effects[1].

   

16-bromo-7E,15E-hexadecadien-5,13-diynoic acid

16-bromo-7E,15E-hexadecadien-5,13-diynoic acid

C16H19BrO2 (322.05683339999996)


   

Gallocatechin-4beta-ol

Gallocatechin-4beta-ol

C15H14O8 (322.0688644)


   

2-OXO-2H,5H-1,6-DIOXA-BENZO[C]PHENANTHRENE-3-CARBOXYLIC ACID ETHYL ESTER

2-OXO-2H,5H-1,6-DIOXA-BENZO[C]PHENANTHRENE-3-CARBOXYLIC ACID ETHYL ESTER

C19H14O5 (322.0841194)


   

2-CHLORO-N-(4-CHLORO-2-((HYDROXYIMINO)(PHENYL)METHYL)PHENYL)ACETAMIDE

2-CHLORO-N-(4-CHLORO-2-((HYDROXYIMINO)(PHENYL)METHYL)PHENYL)ACETAMIDE

C15H12Cl2N2O2 (322.0275792)


   

methyl 4-(methylsulfonamidomethyl)-2-sulfamoylbenzoate

methyl 4-(methylsulfonamidomethyl)-2-sulfamoylbenzoate

C10H14N2O6S2 (322.0293264)


   

5-bromo-2,2-diethoxy-4,5-bipyridine

5-bromo-2,2-diethoxy-4,5-bipyridine

C14H15BrN2O2 (322.031683)


   

1-(3-AMINO-4-CHLOROBENZENESULFONYL)-1,2,3,4-TETRAHYDROQUINOLINE

1-(3-AMINO-4-CHLOROBENZENESULFONYL)-1,2,3,4-TETRAHYDROQUINOLINE

C15H15ClN2O2S (322.054272)


   

Ethanone,1,1-(oxydi-4,1-phenylene)bis[2-chloro-

Ethanone,1,1-(oxydi-4,1-phenylene)bis[2-chloro-

C16H12Cl2O3 (322.01634620000004)


   
   

4-[(2,5-DIOXOTETRAHYDRO-1H-IMIDAZOL-4-YLIDEN)METHYL]PHENYL 3-CHLORO-2,2-DIMETHYLPROPANOATE

4-[(2,5-DIOXOTETRAHYDRO-1H-IMIDAZOL-4-YLIDEN)METHYL]PHENYL 3-CHLORO-2,2-DIMETHYLPROPANOATE

C15H15ClN2O4 (322.07203000000004)


   

1,3-BIS(4-FLUOROBENZOYL)BENZENE

1,3-BIS(4-FLUOROBENZOYL)BENZENE

C20H12F2O2 (322.0805316)


   

6-Benzoyl-4-hydroxy-8-methoxy-2-naphthoic acid

6-Benzoyl-4-hydroxy-8-methoxy-2-naphthoic acid

C19H14O5 (322.0841194)


   

5-Bromo-7,7-dimethyl-7H-benzo[c]fluorene

5-Bromo-7,7-dimethyl-7H-benzo[c]fluorene

C19H15Br (322.035705)


   

3-(4-[(2,4-DICHLOROBENZYL)OXY]PHENYL)ACRYLIC ACID

3-(4-[(2,4-DICHLOROBENZYL)OXY]PHENYL)ACRYLIC ACID

C16H12Cl2O3 (322.01634620000004)


   

3-CHLORO-4-(3,5-DIMETHOXYBENXYLOXY)PH&

3-CHLORO-4-(3,5-DIMETHOXYBENXYLOXY)PH&

C15H16BClO5 (322.0779266)


   

9-BROMO-11,11-DIMETHYL-11H-BENZO[A]FLUORENE

9-BROMO-11,11-DIMETHYL-11H-BENZO[A]FLUORENE

C19H15Br (322.035705)


   

3-(4-((3,4-DICHLOROBENZYL)OXY)PHENYL)ACRYLIC ACID

3-(4-((3,4-DICHLOROBENZYL)OXY)PHENYL)ACRYLIC ACID

C16H12Cl2O3 (322.01634620000004)


   

bis(2-methacryloxyethyl) phosphate

bis(2-methacryloxyethyl) phosphate

C12H19O8P (322.08175040000003)


   

methyl 3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzoate

methyl 3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzoate

C14H15BrN2O2 (322.031683)


   

1,4-BIS(CHLOROMETHYLDIMETHYLSILYLOXY)BENZENE

1,4-BIS(CHLOROMETHYLDIMETHYLSILYLOXY)BENZENE

C12H20Cl2O2Si2 (322.03788399999996)


   

4-chloro-2,5-diphenylthieno[2,3-d]pyrimidine

4-chloro-2,5-diphenylthieno[2,3-d]pyrimidine

C18H11ClN2S (322.0331436)


   

N-[2-butyl-3-[4-(3-butylaMino) propoxy]benzoyl]-5-benzofuranyl] MethanesulfonaMide

N-[2-butyl-3-[4-(3-butylaMino) propoxy]benzoyl]-5-benzofuranyl] MethanesulfonaMide

C12H10N4O3S2 (322.019431)


   

Sulfaquinoxaline sodium salt

Sulfaquinoxaline sodium salt

C14H11N4NaO2S (322.0500386)


   

4-CHLORO-3-((3-CHLORO-5-(TRIFLUOROMETHYL)PYRIDIN-2-YL)OXY)ANILINE

4-CHLORO-3-((3-CHLORO-5-(TRIFLUOROMETHYL)PYRIDIN-2-YL)OXY)ANILINE

C12H7Cl2F3N2O (321.9887508)


   

1-(BENZYLOXY)-4-BROMO-2,5-DIMETHOXYBENZENE

1-(BENZYLOXY)-4-BROMO-2,5-DIMETHOXYBENZENE

C15H15BrO3 (322.02045)


   

3-chloro-2-(3-chloro-4-methoxyphenyl)-5-methoxyindazole

3-chloro-2-(3-chloro-4-methoxyphenyl)-5-methoxyindazole

C15H12Cl2N2O2 (322.0275792)


   

4-bromo-2-(3-hydroxypropyl)-6-(trifluoromethyl)benzimidazole

4-bromo-2-(3-hydroxypropyl)-6-(trifluoromethyl)benzimidazole

C11H10BrF3N2O (321.9928546)


   

1-[(4-METHYLPHENYL)SULFONYL]-1H-INDOL-5-AMINIUM CHLORIDE

1-[(4-METHYLPHENYL)SULFONYL]-1H-INDOL-5-AMINIUM CHLORIDE

C15H15ClN2O2S (322.054272)


   

2-(2-[[(4-CHLOROPHENYL)THIO]METHYL]PHENOXY)ETHANOHYDRAZIDE

2-(2-[[(4-CHLOROPHENYL)THIO]METHYL]PHENOXY)ETHANOHYDRAZIDE

C15H15ClN2O2S (322.054272)


   

4,4-CARBONYLBIS(PHTHALIC ANHYDRIDE)

4,4-CARBONYLBIS(PHTHALIC ANHYDRIDE)

C17H6O7 (322.0113526)


   
   

N,N-bis(3-chlorophenyl)propanediamide

N,N-bis(3-chlorophenyl)propanediamide

C15H12Cl2N2O2 (322.0275792)


   

robinetinidin chloride

robinetinidin chloride

C15H11ClO6 (322.0244136)


   

2-(2-Bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborine

2-(2-Bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborine

C16H12BBrN2 (322.0276842)


   

2-(3-Bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborine

2-(3-Bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborine

C16H12BBrN2 (322.0276842)


   

2-(4-Bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborine

2-(4-Bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborine

C16H12BBrN2 (322.0276842)


   

hexafluoroisopropyl tosylate

hexafluoroisopropyl tosylate

C10H8F6O3S (322.009833)


   

Carbazochrome sodium sulfonate (AC-17)

Carbazochrome sodium sulfonate (AC-17)

C10H11N4NaO5S (322.0347836)


Carbazochrome sodium sulfonate (AC-17) is a capillary stabiliser and used for the research of haemorrhage. Carbazochrome sodium sulfonate is an antihemorrhagic agent[1].

   
   

4-(4-Bromophenyl)dibenzo[b,d]furan

4-(4-Bromophenyl)dibenzo[b,d]furan

C18H11BrO (321.9993216)


   

4-iodo-1-[2-(oxan-2-yloxy)ethyl]pyrazole

4-iodo-1-[2-(oxan-2-yloxy)ethyl]pyrazole

C10H15IN2O2 (322.01782399999996)


   

4-(3-NITRO-BENZENESULFONYLAMINO)-BENZOIC ACID

4-(3-NITRO-BENZENESULFONYLAMINO)-BENZOIC ACID

C13H10N2O6S (322.02595600000006)


   

3-CHLORO-4-{[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]OXY}ANILINE

3-CHLORO-4-{[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]OXY}ANILINE

C12H7Cl2F3N2O (321.9887508)


   

sodium,2-hydroxybenzoate,[(E)-(3-hydroxy-1-methyl-6-oxo-2,3-dihydroindol-5-ylidene)amino]urea

sodium,2-hydroxybenzoate,[(E)-(3-hydroxy-1-methyl-6-oxo-2,3-dihydroindol-5-ylidene)amino]urea

C10H11N4NaO5S (322.0347836)


   

3-Oxo-3H,12H-4,11-dioxa-chrysene-2-carboxylic acid ethyl ester

3-Oxo-3H,12H-4,11-dioxa-chrysene-2-carboxylic acid ethyl ester

C19H14O5 (322.0841194)


   

BIS(TRIMETHYLSILYL)TRIFLUORO ACETYL PHOSPHONATE

BIS(TRIMETHYLSILYL)TRIFLUORO ACETYL PHOSPHONATE

C8H18F3O4PSi2 (322.04333139999994)


   

Ethyl 1-benzyl-4-bromo-3-methyl-1H-pyrazole-5-carboxylate

Ethyl 1-benzyl-4-bromo-3-methyl-1H-pyrazole-5-carboxylate

C14H15BrN2O2 (322.031683)


   

Ethyl 1-benzyl-4-bromo-5-methyl-1H-pyrazole-3-carboxylate

Ethyl 1-benzyl-4-bromo-5-methyl-1H-pyrazole-3-carboxylate

C14H15BrN2O2 (322.031683)


   

2,3-DIPHENYLTETRAZOLIUM PERCHLORATE

2,3-DIPHENYLTETRAZOLIUM PERCHLORATE

C13H11ClN4O4 (322.0468796)


   

ethyl 5-(4-bromophenyl)-1-ethylpyrazole-3-carboxylate

ethyl 5-(4-bromophenyl)-1-ethylpyrazole-3-carboxylate

C14H15BrN2O2 (322.031683)


   

ethyl (E)-3-(2-chlorophenyl)-2-[(1,3-thiazol-2-ylamino)methyl]prop-2-enoate

ethyl (E)-3-(2-chlorophenyl)-2-[(1,3-thiazol-2-ylamino)methyl]prop-2-enoate

C15H15ClN2O2S (322.054272)


   

methyl 3-hydroxy-5-(4-methylsulfonylphenoxy)benzoate

methyl 3-hydroxy-5-(4-methylsulfonylphenoxy)benzoate

C15H14O6S (322.05110640000004)


   

Diethyl tosyloxy methylphosphonate

Diethyl tosyloxy methylphosphonate

C12H19O6PS (322.0639924)


   

2-Hydroxy-5-[(4-sulfophenyl)diazenyl]benzoic acid

2-Hydroxy-5-[(4-sulfophenyl)diazenyl]benzoic acid

C13H10N2O6S (322.02595600000006)


   

2,4,6-tris(trifluoromethyl)-1H-benzimidazole

2,4,6-tris(trifluoromethyl)-1H-benzimidazole

C10H3F9N2 (322.0152506)


   

1,3-Bis-[(chloromethyl)dimethylsiloxy]benzene

1,3-Bis-[(chloromethyl)dimethylsiloxy]benzene

C12H20Cl2O2Si2 (322.03788399999996)


   
   

6-(2-Chloro-5-fluoro-4-pyrimidinyl)-4-fluoro-2-methyl-1-(1-methylethyl)-1H-benzimidazole

6-(2-Chloro-5-fluoro-4-pyrimidinyl)-4-fluoro-2-methyl-1-(1-methylethyl)-1H-benzimidazole

C15H13ClF2N4 (322.0796752)


   

2-Amino-6-bromo-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7(8H)-one

2-Amino-6-bromo-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7(8H)-one

C13H15BrN4O (322.042916)


   
   

4-bromo-6-phenyldibenzo[b,d]furan

4-bromo-6-phenyldibenzo[b,d]furan

C18H11BrO (321.9993216)


   

2-Bromo-11,11-dimethyl-11H-benzo[b]fluorene

2-Bromo-11,11-dimethyl-11H-benzo[b]fluorene

C19H15Br (322.035705)


   

2-CHLORO-N-(4-(PYRIDIN-4-YLMETHYL)PHENYL)BENZAMIDE

2-CHLORO-N-(4-(PYRIDIN-4-YLMETHYL)PHENYL)BENZAMIDE

C19H15ClN2O (322.087285)


   

3-CHLORO-N-(4-(PHENYLAMINO)PHENYL)BENZAMIDE

3-CHLORO-N-(4-(PHENYLAMINO)PHENYL)BENZAMIDE

C19H15ClN2O (322.087285)


   

tert-Butyl 3-(4-bromophenyl)-1H-pyrazole-1-carboxylate

tert-Butyl 3-(4-bromophenyl)-1H-pyrazole-1-carboxylate

C14H15BrN2O2 (322.031683)


   

5-[[(7-CHLORO-4-QUINOLINYL)SULFANYL]METHYL]-4-METHYL-4H-1,2,4-TRIAZOLE-3-THIOL

5-[[(7-CHLORO-4-QUINOLINYL)SULFANYL]METHYL]-4-METHYL-4H-1,2,4-TRIAZOLE-3-THIOL

C13H11ClN4S2 (322.0113636)


   

4-Iodo-4-propylbiphenyl

4-Iodo-4-propylbiphenyl

C15H15I (322.021846)


   

bis(4-trifluoromethylphenyl)phosphine

bis(4-trifluoromethylphenyl)phosphine

C14H9F6P (322.0346036)


   
   

5-Bromo-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine

5-Bromo-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine

C13H16BBrN2O2 (322.04881259999996)


   

1,4-Phenylenebis[(4-fluorophenyl)methanone]

1,4-Phenylenebis[(4-fluorophenyl)methanone]

C20H12F2O2 (322.0805316)


   

(5-BROMO-ISOQUINOLIN-1-YL)-CARBAMIC ACID TERT-BUTYL ESTER

(5-BROMO-ISOQUINOLIN-1-YL)-CARBAMIC ACID TERT-BUTYL ESTER

C14H15BrN2O2 (322.031683)


   
   

2-(2-Methoxyphenoxy)ethyl 4-toluenesulfonate

2-(2-Methoxyphenoxy)ethyl 4-toluenesulfonate

C16H18O5S (322.0874898)


   

2-Bromo-1-(1-pyrenyl)ethanone

2-Bromo-1-(1-pyrenyl)ethanone

C18H11BrO (321.9993216)


   

iron(2+),6-[[2-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one

iron(2+),6-[[2-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one

C16H14FeN2O2 (322.04046139999997)


   

2-benzofuran-1,3-dione,furan-2,5-dione,propane-1,2-diol

2-benzofuran-1,3-dione,furan-2,5-dione,propane-1,2-diol

C15H14O8 (322.0688644)


   

4-[3-(4-Chlorophenyl)-2,1-benzisoxazol-5-yl]pyrimidin-2-amine

4-[3-(4-Chlorophenyl)-2,1-benzisoxazol-5-yl]pyrimidin-2-amine

C17H11ClN4O (322.0621346)


   

(5-Chloropyrazolo[1,5-A]pyrimidin-7-YL)-(4-methanesulfonylphenyl)amine

(5-Chloropyrazolo[1,5-A]pyrimidin-7-YL)-(4-methanesulfonylphenyl)amine

C13H11ClN4O2S (322.0291216)


   

7,8-Dihydroxy-1-methoxy-3-methyl-10-oxo-4,10-dihydro-1H,3H-pyrano[4,3-B]chromene-9-carboxylic acid

7,8-Dihydroxy-1-methoxy-3-methyl-10-oxo-4,10-dihydro-1H,3H-pyrano[4,3-B]chromene-9-carboxylic acid

C15H14O8 (322.0688644)


An organic heterotricyclic compound that is 4,10-dihydro-1H,3H-pyrano[4,3-b]chromene substituted by hydroxy groups at positions 7 and 8, a methoxy group at position 1, a methyl group at position 3, an oxo group at position 10 and a carboxy group at position 9. Isolated from Chaetomium funicola it exhibits inhibitory activity against metallo-beta-lactamases.

   

4-Deoxy-4-acetylyamino-pyridoxal-5-phosphate

4-Deoxy-4-acetylyamino-pyridoxal-5-phosphate

C10H15N2O8P (322.0566)


   

UMP dianion

UMP dianion

C9H11N2O9P-2 (322.0202166)


COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

6-Deoxyversicolorin A

6-Deoxyversicolorin A

C18H10O6 (322.047736)


   

(2S)-2-(2-(3-Hydroxy-2-oxoindolin-3-yl)acetamido)succinic acid

(2S)-2-(2-(3-Hydroxy-2-oxoindolin-3-yl)acetamido)succinic acid

C14H14N2O7 (322.0800974)


   

N-(6-Chloro-9h-pyrido[3,4-b]indol-8-yl)-3-pyridinecarboxamide

N-(6-Chloro-9h-pyrido[3,4-b]indol-8-yl)-3-pyridinecarboxamide

C17H11ClN4O (322.0621346)


   

3-[(4-Bromophenyl)methoxy]-6-methyl-2-nitropyridine

3-[(4-Bromophenyl)methoxy]-6-methyl-2-nitropyridine

C13H11BrN2O3 (321.99529959999995)


   

N-(2-methoxy-4-nitrophenyl)-2-[(1-methyl-2-imidazolyl)thio]acetamide

N-(2-methoxy-4-nitrophenyl)-2-[(1-methyl-2-imidazolyl)thio]acetamide

C13H14N4O4S (322.07357240000005)


   
   

5-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-4-ethyl-4H-1,2,4-triazole-3-thiol

5-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-4-ethyl-4H-1,2,4-triazole-3-thiol

C13H11ClN4S2 (322.0113636)


   

N-(4-chloro-2,5-dimethoxyphenyl)-5-cyclopropyl-3-isoxazolecarboxamide

N-(4-chloro-2,5-dimethoxyphenyl)-5-cyclopropyl-3-isoxazolecarboxamide

C15H15ClN2O4 (322.07203000000004)


   

4-[(3-Methylphenyl)sulfanyl]-2-phenyl-5-pyrimidinecarboxylic acid

4-[(3-Methylphenyl)sulfanyl]-2-phenyl-5-pyrimidinecarboxylic acid

C18H14N2O2S (322.0775944)


   

10-(3-Aminopropyl)-8-chlorophenothiazine-2,3-diol

10-(3-Aminopropyl)-8-chlorophenothiazine-2,3-diol

C15H15ClN2O2S (322.054272)


D004791 - Enzyme Inhibitors > D000067956 - Adenylyl Cyclase Inhibitors

   

1-[7-(2,4-Dichlorophenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethanone

1-[7-(2,4-Dichlorophenyl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethanone

C14H12Cl2N4O (322.0388122)


   

1-(2-deoxy-5-O-phosphono-beta-L-erythro-pentofuranosyl)-5-methylpyrimidine-2,4(1H,3H)-dione

1-(2-deoxy-5-O-phosphono-beta-L-erythro-pentofuranosyl)-5-methylpyrimidine-2,4(1H,3H)-dione

C10H15N2O8P (322.0566)


   
   

N-(4-chlorophenyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide

N-(4-chlorophenyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide

C15H15ClN2O2S (322.054272)


   

2-[1-(4-Chloro-phenyl)-ethyl]-4,6-dinitro-phenol

2-[1-(4-Chloro-phenyl)-ethyl]-4,6-dinitro-phenol

C14H11ClN2O5 (322.0356466)


   

Trofosfamide

Trofosfamide

C9H18Cl3N2O2P (322.01714280000004)


L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01A - Alkylating agents > L01AA - Nitrogen mustard analogues D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D009588 - Nitrogen Mustard Compounds D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D010752 - Phosphoramide Mustards C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D009676 - Noxae > D000477 - Alkylating Agents D009676 - Noxae > D009153 - Mutagens

   

Tazobactam sodium

Tazobactam Sodium Salt

C10H11N4NaO5S (322.0347836)


An organic sodium salt having tazobactam(1-) as the counterion; used in combination with ceftolozane sulfate for treatment of complicated intra-abdominal infections and complicated urinary tract infections. D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D065093 - beta-Lactamase Inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D010406 - Penicillins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C2140 - Adjuvant > C183118 - Beta-lactamase Inhibitor D004791 - Enzyme Inhibitors

   

digallate

3,4-dihydroxy-5-[oxo-(3,4,5-trihydroxyphenyl)methoxy]benzoic acid

C14H10O9 (322.032481)


D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors

   

Gallic acid 3-O-gallate

Benzoic acid,3,4-dihydroxy-5-[(3,4,5-trihydroxybenzoyl)oxy]-

C14H10O9 (322.032481)


Digallic acid is a polyphenolic compound found in Pistacia lentiscus. Digallic acid is also present in the molecule of tannic acid. Digalloyl esters involve either -meta or -para depside bonds. [Wikipedia]

   

[3-Hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate

[3-Hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate

C10H15N2O8P (322.0566)


   

7,8-dihydroxy-1-methoxy-3-methyl-10-oxo-3,4-dihydro-1H-pyrano[4,3-b]chromene-9-carboxylic acid

7,8-dihydroxy-1-methoxy-3-methyl-10-oxo-3,4-dihydro-1H-pyrano[4,3-b]chromene-9-carboxylic acid

C15H14O8 (322.0688644)


   

3-Thymidylic acid

3-Thymidylic acid

C10H15N2O8P (322.0566)


   

p-Mercuribenzoate

p-Mercuribenzoate

C7H4HgO2- (321.9917604)


D010575 - Pesticides > D005659 - Fungicides, Industrial > D010663 - Phenylmercury Compounds D004791 - Enzyme Inhibitors > D008626 - Mercuribenzoates

   
   

Pseudouridine 5-phosphate(2-)

Pseudouridine 5-phosphate(2-)

C9H11N2O9P-2 (322.0202166)


   
   

8-Methyltetraphene-1,5,6,11,12-pentol

8-Methyltetraphene-1,5,6,11,12-pentol

C19H14O5 (322.0841194)


   
   

Arabinouracil 5-monophosphate

Arabinouracil 5-monophosphate

C9H11N2O9P-2 (322.0202166)


   

9-decarboxy-tetracenomycin F1

9-decarboxy-tetracenomycin F1

C19H14O5 (322.0841194)


   

2-Oxo-3-(phosphooxy)propyl 7-methyl-3-oxooctanoate

2-Oxo-3-(phosphooxy)propyl 7-methyl-3-oxooctanoate

C12H19O8P-2 (322.08175040000003)


   

[4-[(3S)-7-hydroxy-3,4-dihydro-2H-chromen-3-yl]phenyl] hydrogen sulfate

[4-[(3S)-7-hydroxy-3,4-dihydro-2H-chromen-3-yl]phenyl] hydrogen sulfate

C15H14O6S (322.05110640000004)


   

Sodium sulfate decahydrate

Sodium sulfate decahydrate

H20Na2O14S (322.036914)


C78275 - Agent Affecting Blood or Body Fluid > C29730 - Electrolyte Replacement Agent D005765 - Gastrointestinal Agents > D002400 - Cathartics

   

(+)-3,4-dihydro-3,8-dihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione

(+)-3,4-dihydro-3,8-dihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione

C19H14O5 (322.0841194)


   

5-(4-bromophenyl)-N,N-diethyl-3-isoxazolecarboxamide

5-(4-bromophenyl)-N,N-diethyl-3-isoxazolecarboxamide

C14H15BrN2O2 (322.031683)


   

N-(5-bromo-2-pyridinyl)-2,2-dimethyl-3-(2-methylprop-1-enyl)-1-cyclopropanecarboxamide

N-(5-bromo-2-pyridinyl)-2,2-dimethyl-3-(2-methylprop-1-enyl)-1-cyclopropanecarboxamide

C15H19BrN2O (322.06806639999996)


   

2-[1-(p-Chlorophenyl)ethyl]-4,6-dinitrophenol

2-[1-(p-Chlorophenyl)ethyl]-4,6-dinitrophenol

C14H11ClN2O5 (322.0356466)


   

N-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-benzothiazole-2-carboxamide

N-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-benzothiazole-2-carboxamide

C16H10N4O2S (322.05244400000004)


   

4-[(5-Bromo-8-quinolinyl)amino]-4-oxobutanoic acid

4-[(5-Bromo-8-quinolinyl)amino]-4-oxobutanoic acid

C13H11BrN2O3 (321.99529959999995)


   

2-Pyridinecarboxylic acid [2-[2-(difluoromethoxy)anilino]-2-oxoethyl] ester

2-Pyridinecarboxylic acid [2-[2-(difluoromethoxy)anilino]-2-oxoethyl] ester

C15H12F2N2O4 (322.0765096)


   

N-[2,2-dimethyl-3-[[oxo(thiophen-2-yl)methyl]amino]propyl]-2-thiophenecarboxamide

N-[2,2-dimethyl-3-[[oxo(thiophen-2-yl)methyl]amino]propyl]-2-thiophenecarboxamide

C15H18N2O2S2 (322.0809648)


   

3-(4-chlorophenyl)-5-(3-phenyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole

3-(4-chlorophenyl)-5-(3-phenyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole

C17H11ClN4O (322.0621346)


   

2-[5-(3-chlorophenyl)furan-2-yl]quinazolin-4(3H)-one

2-[5-(3-chlorophenyl)furan-2-yl]quinazolin-4(3H)-one

C18H11ClN2O2 (322.0509016)


   
   
   

(+/-)-Equol 4-sulfate (sodium salt)

(+/-)-Equol 4-sulfate (sodium salt)

C15H14O6S (322.05110640000004)


   

Methyl (2E)-2-(3,5-dioxo-4-phenyloxolan-2-ylidene)-2-phenylacetate

Methyl (2E)-2-(3,5-dioxo-4-phenyloxolan-2-ylidene)-2-phenylacetate

C19H14O5 (322.0841194)


   

{3-[3-(2-Hydroxyphenyl)propanoyl]phenyl}oxidanesulfonic acid

{3-[3-(2-Hydroxyphenyl)propanoyl]phenyl}oxidanesulfonic acid

C15H14O6S (322.05110640000004)


   

[1-[(3,4-Dichlorophenyl)methyl]-2-hydroxyindol-3-yl]-oxidoazanium

[1-[(3,4-Dichlorophenyl)methyl]-2-hydroxyindol-3-yl]-oxidoazanium

C15H12Cl2N2O2 (322.0275792)


   

Methyl 3,7,8-trihydroxy-3-methyl-10-oxo-1,4-dihydropyrano[4,3-b]chromene-9-carboxylate

Methyl 3,7,8-trihydroxy-3-methyl-10-oxo-1,4-dihydropyrano[4,3-b]chromene-9-carboxylate

C15H14O8 (322.0688644)


   

Merdafos

Sulprofos

C12H19O2PS3 (322.0284764)


C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor

   

Digallic acid

Benzoic acid,3,4-dihydroxy-5-[(3,4,5-trihydroxybenzoyl)oxy]-

C14H10O9 (322.032481)


D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors

   
   

2,2-dichloro-N-[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]acetamide

2,2-dichloro-N-[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]acetamide

C11H12Cl2N2O5 (322.0123242)


   

7,7-Dihydroxy-6,8-bicoumarin

7,7-Dihydroxy-6,8-bicoumarin

C18H10O6 (322.047736)


   

4-(3,4-Dihydroxyphenyl)-2,3-dihydro-2,3-dihydroxy-1H-phenalen-1-one

4-(3,4-Dihydroxyphenyl)-2,3-dihydro-2,3-dihydroxy-1H-phenalen-1-one

C19H14O5 (322.0841194)


   
   

flavan-3,3,4,4,5,5,7-heptol

flavan-3,3,4,4,5,5,7-heptol

C15H14O8 (322.0688644)


A flavanol that is 3,4-dihydro-2H-chromene which is substituted at positions 3, 4, 5, and 7 by hydroxy groups, and at position 2 by a 3,4,5-trihydroxyphenyl group.

   

uridine 5-monophosphate(2-)

uridine 5-monophosphate(2-)

C9H11N2O9P (322.0202166)


A pyrimidine nucleoside 5-monophosphate(2-) that results from the removal of two protons from the phosphate group of UMP.

   

Ribavirin 5-monophosphate(2-)

Ribavirin 5-monophosphate(2-)

C8H11N4O8P (322.03144960000003)


An organophosphate oxoanion resulting from the removal of both protons from the phosphate group of ribavirin 5-monophosphate. It is the major species at pH 7.3.

   

3-UMP(2-)

3-UMP(2-)

C9H11N2O9P (322.0202166)


A nucleoside 3-phosphate(2-) obtained by deprotonation of the phosphate OH groups of uridine 3-monophosphate (UMP). It is the predominant species at physiological pH.

   

Pseudouridine 5-phosphate(2-)

Pseudouridine 5-phosphate(2-)

C9H11N2O9P (322.0202166)


An organophosphate oxoanion arising from deprotonation of the phosphate OH groups of pseudouridine 5-phosphate; major species at pH 7.3.

   

(2R,3S,4S)-leucodelphinidin

(2R,3S,4S)-leucodelphinidin

C15H14O8 (322.0688644)


A flavan-3,3,4,4,5,5,7-heptol that has (2R,3S,4S) configuration.

   

Azvudine (hydrochloride)

Azvudine (hydrochloride)

C9H12ClFN6O4 (322.0592554)


Azvudine (RO-0622) hydrochloride is a potent nucleoside reverse transcriptase inhibitor (NRTI), with antiviral activity on HIV, HBV and HCV. Azvudine hydrochloride exerts highly potent inhibition on HIV-1 (EC50s ranging from 0.03 to 6.92 nM) and HIV-2 (EC50s ranging from 0.018 to 0.025 nM). Azvudine hydrochloride inhibits NRTI-resistant viral strains[1]. Azvudine (hydrochloride) is a click chemistry reagent, it contains an Azide group and can undergo copper-catalyzed azide-alkyne cycloaddition reaction (CuAAc) with molecules containing Alkyne groups. Strain-promoted alkyne-azide cycloaddition (SPAAC) can also occur with molecules containing DBCO or BCN groups.

   

Oxotremorine M (iodide)

Oxotremorine M (iodide)

C11H19IN2O (322.0542074)


Oxotremorine M iodide is a potent and non-selective muscarinic acetylcholine receptor (mAChR) agonist. Oxotremorine M iodide potentiates NMDA receptors by muscarinic receptor dependent and independent mechanisms[1].

   

α-D-Glucose-1-phosphate (disodium hydrate)

α-D-Glucose-1-phosphate (disodium hydrate)

C6H13Na2O10P (322.00417280000005)


α-D-Glucose-1-phosphate disodium hydrate is used as a starting material for synthesis of glucuronic acid. α-D-Glucose-1-phosphate disodium hydrate can be used as a cytostatic compound essential for cardiopathic therapy, as an antibiotic, as an immunosuppressive agent, and as a circulatory system therapy element[1].

   

7,8-dihydroxy-3-methoxy-3-methyl-10-oxo-1h,4h-pyrano[4,3-b]chromene-9-carboxylic acid

7,8-dihydroxy-3-methoxy-3-methyl-10-oxo-1h,4h-pyrano[4,3-b]chromene-9-carboxylic acid

C15H14O8 (322.0688644)


   

4-{4-hydroxy-2',4'-dioxaspiro[cyclopentane-1,3'-tricyclo[7.3.1.0⁵,¹³]tridecane]-1'(13'),2,5',7',9',11'-hexaen-5-ylidene}but-2-enoic acid

4-{4-hydroxy-2',4'-dioxaspiro[cyclopentane-1,3'-tricyclo[7.3.1.0⁵,¹³]tridecane]-1'(13'),2,5',7',9',11'-hexaen-5-ylidene}but-2-enoic acid

C19H14O5 (322.0841194)


   

(1s,2's)-4-hydroxy-6-methoxy-2'-methyl-3,5'-dioxospiro[2-benzofuran-1,3'-oxolan]-2'-ylacetic acid

(1s,2's)-4-hydroxy-6-methoxy-2'-methyl-3,5'-dioxospiro[2-benzofuran-1,3'-oxolan]-2'-ylacetic acid

C15H14O8 (322.0688644)


   

2-(2-hydroxyphenyl)-5-(4-hydroxyphenyl)-3-methoxycyclohexa-2,5-diene-1,4-dione

2-(2-hydroxyphenyl)-5-(4-hydroxyphenyl)-3-methoxycyclohexa-2,5-diene-1,4-dione

C19H14O5 (322.0841194)


   

(5s)-5-hydroxy-7-methoxy-10-phenyl-3-oxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),6,9(13),10-tetraene-2,8-dione

(5s)-5-hydroxy-7-methoxy-10-phenyl-3-oxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),6,9(13),10-tetraene-2,8-dione

C19H14O5 (322.0841194)


   

4-[(2r)-3-chloro-2-hydroxy-3-methylbutoxy]furo[3,2-g]chromen-7-one

4-[(2r)-3-chloro-2-hydroxy-3-methylbutoxy]furo[3,2-g]chromen-7-one

C16H15ClO5 (322.060797)


   

7-bromo-2-methyl-2-(4-methylpent-3-en-1-yl)chromen-6-ol

7-bromo-2-methyl-2-(4-methylpent-3-en-1-yl)chromen-6-ol

C16H19BrO2 (322.05683339999996)


   

1-[(1r,12r)-16-hydroxy-6,11,19-trioxapentacyclo[10.8.0.0²,¹⁰.0⁵,⁹.0¹³,¹⁸]icosa-2,4,7,9,13,15,17-heptaen-7-yl]ethanone

1-[(1r,12r)-16-hydroxy-6,11,19-trioxapentacyclo[10.8.0.0²,¹⁰.0⁵,⁹.0¹³,¹⁸]icosa-2,4,7,9,13,15,17-heptaen-7-yl]ethanone

C19H14O5 (322.0841194)


   

(3z,5e,7e,9e,11r)-1,1,1-trichloro-4-hydroxy-11-methyltrideca-3,5,7,9-tetraen-2-one

(3z,5e,7e,9e,11r)-1,1,1-trichloro-4-hydroxy-11-methyltrideca-3,5,7,9-tetraen-2-one

C14H17Cl3O2 (322.02940720000004)


   

(2s)-7,9-dihydroxy-2-(prop-1-en-2-yl)-1h,2h-anthra[2,1-b]furan-6,11-dione

(2s)-7,9-dihydroxy-2-(prop-1-en-2-yl)-1h,2h-anthra[2,1-b]furan-6,11-dione

C19H14O5 (322.0841194)


   

1,1,1-trichloro-4-hydroxy-11-methyltrideca-3,5,7,9-tetraen-2-one

1,1,1-trichloro-4-hydroxy-11-methyltrideca-3,5,7,9-tetraen-2-one

C14H17Cl3O2 (322.02940720000004)


   

(2s)-2-amino-4-{[(1r)-1-carboxy-2-(prop-2-en-1-yldisulfanyl)ethyl]-c-hydroxycarbonimidoyl}butanoic acid

(2s)-2-amino-4-{[(1r)-1-carboxy-2-(prop-2-en-1-yldisulfanyl)ethyl]-c-hydroxycarbonimidoyl}butanoic acid

C11H18N2O5S2 (322.0657098)


   

2-[(dichloromethoxy)methyl]-3-hydroxy-3-(4-nitrophenyl)propanimidic acid

2-[(dichloromethoxy)methyl]-3-hydroxy-3-(4-nitrophenyl)propanimidic acid

C11H12Cl2N2O5 (322.0123242)


   

3,8-dihydroxy-7-methoxy-3-methyl-10-oxo-1h,4h-pyrano[4,3-b]chromene-6-carboxylic acid

3,8-dihydroxy-7-methoxy-3-methyl-10-oxo-1h,4h-pyrano[4,3-b]chromene-6-carboxylic acid

C15H14O8 (322.0688644)


   

8-hydroxy-3-(hydroxymethyl)-3,4-dihydro-2h-tetraphene-1,7,12-trione

8-hydroxy-3-(hydroxymethyl)-3,4-dihydro-2h-tetraphene-1,7,12-trione

C19H14O5 (322.0841194)


   

(4s)-4,8-dihydroxy-7-methoxy-10-phenyl-3-oxatricyclo[7.3.1.0⁵,¹³]trideca-1(13),5,7,9,11-pentaen-2-one

(4s)-4,8-dihydroxy-7-methoxy-10-phenyl-3-oxatricyclo[7.3.1.0⁵,¹³]trideca-1(13),5,7,9,11-pentaen-2-one

C19H14O5 (322.0841194)


   

1-{16-hydroxy-6,11,19-trioxapentacyclo[10.8.0.0²,¹⁰.0⁵,⁹.0¹³,¹⁸]icosa-2,4,7,9,13,15,17-heptaen-7-yl}ethanone

1-{16-hydroxy-6,11,19-trioxapentacyclo[10.8.0.0²,¹⁰.0⁵,⁹.0¹³,¹⁸]icosa-2,4,7,9,13,15,17-heptaen-7-yl}ethanone

C19H14O5 (322.0841194)


   

(1s,3s)-7,8-dihydroxy-1-methoxy-3-methyl-10-oxo-1h,3h,4h-pyrano[4,3-b]chromene-9-carboxylic acid

(1s,3s)-7,8-dihydroxy-1-methoxy-3-methyl-10-oxo-1h,3h,4h-pyrano[4,3-b]chromene-9-carboxylic acid

C15H14O8 (322.0688644)