Exact Mass: 330.0457

Exact Mass Matches: 330.0457

Found 138 metabolites which its exact mass value is equals to given mass value 330.0457, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Malathion

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

C10H19O6PS2 (330.0361)


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

   

3,5-Cyclic IMP

3,5-Cyclic Inosine monophosphate (cIMP)

C10H11N4O7P (330.0365)


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

   

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

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

C14H10ClF3N2O2 (330.0383)


   

Aluminium acetoacetate

Aluminium acetoacetate

C12H15AlO9 (330.0531)


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

   

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 (330.0376)


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.

   

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 (330.0365)


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 (330.0376)


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 (330.0376)


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.

   

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 (330.0376)


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

   
   

(3Z)-13-epi-Pinnatifidenyne

(3Z)-13-epi-Pinnatifidenyne

C15H20BrClO (330.0386)


   
   

3,3-Dimethoxyellagic acid

3,3-Di-O-methylellagic acid

C16H10O8 (330.0376)


   
   

4,4-Di-O-methylellagic acid

4,4-Di-O-methylellagic acid

C16H10O8 (330.0376)


   

(+)-(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 (330.0386)


   
   
   
   

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 (330.0386)


   
   
   
   
   

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 (330.0376)


   

Ceroalbolinic acid

Ceroalbolinic acid

C16H10O8 (330.0376)


   

ellagic acid 3,3-dimethyl ether

ellagic acid 3,3-dimethyl ether

C16H10O8 (330.0376)


   
   

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 (330.0376)


   

rhodolamprometrin

rhodolamprometrin

C16H10O8 (330.0376)


   

4,3-di-O-methylellagic acid

4,3-di-O-methylellagic acid

C16H10O8 (330.0376)


   

2,3 Cyclic imp

Inosine cyclic 2,3-(hydrogen phosphate)

C10H11N4O7P (330.0365)


   

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 (330.0376)


   

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 (330.0376)


   
   

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 (330.0497)


   

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

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

C14H10N4O4S (330.0423)


   

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

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

C14H11BClF3O3 (330.0442)


   

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

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

C14H11BClF3O3 (330.0442)


   
   

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 (330.0417)


   

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

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

C15H17Cl3N2 (330.0457)


   

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

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

C15H17Cl3N2 (330.0457)


   

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

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

C15H15NaO5S (330.0538)


   

3,3,4,4-Biphenyltetracarboxylic acid

3,3,4,4-Biphenyltetracarboxylic acid

C16H10O8 (330.0376)


   

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

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

C15H17Cl3N2 (330.0457)


   

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 (330.0438)


   

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

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

C16H10O8 (330.0376)


   

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

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

C15H11ClN4O3 (330.052)


   

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

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

C13H17BBrFO3 (330.0438)


   

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

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

C14H11BClF3O3 (330.0442)


   

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

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

C14H10N4O4S (330.0423)


   

Kermesic Acid

Kermesic Acid

C16H10O8 (330.0376)


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.

   
   
   

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

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

C14H10ClF3N2O2 (330.0383)


   

Geranyl S-thiolodiphosphate

Geranyl S-thiolodiphosphate

C10H20O6P2S (330.0456)


   

2-Deoxyinosine 5-phosphate(2-)

2-Deoxyinosine 5-phosphate(2-)

C10H11N4O7P-2 (330.0365)


   

Inosine 2,3-cyclic phosphate

Inosine 2,3-cyclic phosphate

C10H11N4O7P (330.0365)


   

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

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

C16H11ClN2O4 (330.0407)


   

(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 (330.0474)


   

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 (330.052)


   

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 (330.0474)


   

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 (330.0497)


   
   

Calcium dihydrogen ethylenediaminetetraacetate

Calcium dihydrogen ethylenediaminetetraacetate

C10H14CaN2O8 (330.0376)


   

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 (330.0488)


   

malathion

malathion

C10H19O6PS2 (330.0361)


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

   

3,4-Di-O-methylellagic acid

3,4-Di-O-methylellagic acid

C16H10O8 (330.0376)


   
   

2-Deoxyinosine 5-phosphate(2-)

2-Deoxyinosine 5-phosphate(2-)

C10H11N4O7P (330.0365)


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 (330.0488)


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.

   
   
   

(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 (330.0386)


   

(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 (330.0386)


   

(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 (330.0386)


   

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 (330.0376)


   

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 (330.0365)


   

(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 (330.0386)


   

(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 (330.0386)


   

10-deactyltyunnanaxane

NA

C16H10O8 (330.0376)


{"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 (330.0376)


{"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 (330.0376)


{"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 (330.0376)


{"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 (330.0376)


{"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 (330.0386)


   

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 (330.0386)


   

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

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

C16H10O8 (330.0376)


   

(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 (330.0386)


   

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 (330.0386)


   

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 (330.0386)


   

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 (330.0376)


   

(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 (330.0386)


   

(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 (330.0386)


   

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 (330.0386)


   

(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 (330.0386)


   

(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 (330.0386)


   

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 (330.0386)


   

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 (330.0386)


   

(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 (330.0386)


   

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 (330.0481)


   

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 (330.048)


   

(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 (330.0386)


   

(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 (330.0386)


   

(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 (330.0386)


   

(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 (330.0386)


   

(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 (330.0386)


   

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 (330.0376)


   

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 (330.0386)


   

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

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

C20H10O5 (330.0528)


   

(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 (330.0386)


   

(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 (330.0386)


   

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 (330.0376)


   

(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 (330.0386)


   

(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 (330.0386)


   

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 (330.0386)


   

(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 (330.0386)


   

(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 (330.0386)


   

(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 (330.0386)


   

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

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

C16H10O8 (330.0376)


   

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 (330.0376)


   

(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 (330.0386)


   

(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 (330.0386)


   

(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 (330.0386)


   

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 (330.0368)


   

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 (330.0386)


   

(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 (330.0386)


   

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 (330.0376)


   

(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 (330.0386)


   

(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 (330.0386)


   

(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 (330.0386)


   

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 (330.0376)


   

(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 (330.0386)


   

(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 (330.0481)


   

(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 (330.0386)


   

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 (330.0386)