Exact Mass: 220.0463
Exact Mass Matches: 220.0463
Found 500 metabolites which its exact mass value is equals to given mass value 220.0463,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
purpurogallin
Purpurogallin is a cyclic ketone that is 5H-benzocycloheptene bearing an oxo group at position 5 and hydroxy groups at positions 2, 3, 4 and 6. It has a role as an antibacterial agent, an antioxidant, an EC 1.17.3.2 (xanthine oxidase) inhibitor and a protective agent. It is a tetrol, a cyclic ketone and a member of phenols. It derives from a hydride of a 5H-benzocycloheptene. Purpurogalline is a natural product found in Quercus with data available. Purpurogallin is a naturally phenol extracted from the plants of Quercus spp, has potent xanthine oxidase (XO) inhibitory activity with an IC50 of 0.2 μM. Purpurogallin has antioxidant and anti-inflammatory effects[1][2][3].
Canthin-6-one
Canthin-6-one is an indole alkaloid that is 6H-indolo[3,2,1-de][1,5]naphthyridine substituted by an oxo group at position 6. It has a role as a metabolite and an antimycobacterial drug. It is an indole alkaloid, an organic heterotetracyclic compound and an enone. Canthin-6-one is a natural product found in Zanthoxylum mayu, Zanthoxylum ovalifolium, and other organisms with data available. D016573 - Agrochemicals D010575 - Pesticides Canthin-6-one displays a wide range of biological activities, such as antimycobacterial activity[1]. Canthin-6-one displays a wide range of biological activities, such as antimycobacterial activity[1].
Thidiazuron
CONFIDENCE standard compound; INTERNAL_ID 458; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8119; ORIGINAL_PRECURSOR_SCAN_NO 8115 CONFIDENCE standard compound; INTERNAL_ID 458; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4000; ORIGINAL_PRECURSOR_SCAN_NO 3997 CONFIDENCE standard compound; INTERNAL_ID 458; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3995; ORIGINAL_PRECURSOR_SCAN_NO 3992 CONFIDENCE standard compound; INTERNAL_ID 458; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8157; ORIGINAL_PRECURSOR_SCAN_NO 8154 CONFIDENCE standard compound; INTERNAL_ID 458; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8104; ORIGINAL_PRECURSOR_SCAN_NO 8102 CONFIDENCE standard compound; INTERNAL_ID 458; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8063; ORIGINAL_PRECURSOR_SCAN_NO 8061 CONFIDENCE standard compound; INTERNAL_ID 458; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8158; ORIGINAL_PRECURSOR_SCAN_NO 8156 CONFIDENCE standard compound; INTERNAL_ID 458; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3985; ORIGINAL_PRECURSOR_SCAN_NO 3983 CONFIDENCE standard compound; INTERNAL_ID 458; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4001; ORIGINAL_PRECURSOR_SCAN_NO 3997 CONFIDENCE standard compound; INTERNAL_ID 458; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8147; ORIGINAL_PRECURSOR_SCAN_NO 8144 CONFIDENCE standard compound; INTERNAL_ID 458; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3963; ORIGINAL_PRECURSOR_SCAN_NO 3962 CONFIDENCE standard compound; INTERNAL_ID 458; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3980; ORIGINAL_PRECURSOR_SCAN_NO 3979
3-[6-(Carboxymethylene)cyclohexa-2,4-dien-1-ylidene]-2-oxopropanate
Imidazole acetol-phosphate
Imidazole acetol-phosphate is involved in the histidine biosynthesis I pathway. Imidazole acetol-phosphate is created by the breakdown of D-erythro-imidazole-glycerol-phosphate into imidazole acetol-phosphate and H2O. Imidazoleglycerol-phosphate dehydratase catalyzes this reaction. Imidazole acetol-phosphate reacts with L-glutamate to produce L-histidinol-phosphate and 2-ketoglutarate. Histidinol-phosphate aminotransferase catalyzes this reaction. Imidazole acetol-phosphate is involved in the histidine biosynthesis I pathway. Imidazole acetol-phosphate is created by the breakdown of D-erythro-imidazole-glycerol-phosphate into imidazole acetol-phosphate and H2O. Imidazoleglycerol-phosphate dehydratase catalyzes this reaction.
N-Acetyl-S-(N-methylcarbamoyl)cysteine
N-acetyl-s-(n-methylcarbamoyl)cysteine belongs to the family of N-acyl-alpha Amino Acids and Derivatives. These are compounds containing an alpha amino acid which bears an acyl group at his terminal nitrogen atom.
2-(2-Thienylmethylene)-1,6-dioxaspiro[4.4]non-3-ene
2-(2-Thienylmethylene)-1,6-dioxaspiro[4.4]non-3-ene is found in herbs and spices. 2-(2-Thienylmethylene)-1,6-dioxaspiro[4.4]non-3-ene is isolated from Chrysanthemum coronarium (chop-suey greens Isolated from Chrysanthemum coronarium (chop-suey greens). 2-(2-Thienylmethylene)-1,6-dioxaspiro[4.4]non-3-ene is found in herbs and spices.
L-beta-aspartyl-L-serine
L-beta-aspartyl-l-serine is a proteolytic breakdown product of larger proteins. It belongs to the family of N-acyl-alpha Amino Acids and Derivatives. These are compounds containing an alpha amino acid which bears an acyl group at his terminal nitrogen atom. It is found in urine (PMID: 3782411). A dipeptide found in urine (PMID: 3782411). This is a proteolytic breakdown product of larger proteins. [HMDB]
Chrycorin
Chrycorin is found in herbs and spices. Chrycorin is isolated from Chrysanthemum coronarium (chop-suey greens Isolated from Chrysanthemum coronarium (chop-suey greens). Chrycorin is found in herbs and spices.
Dracunculin
Dracunculin is found in mugwort. Dracunculin is a constituent of Artemisia dracunculoides (Russian tarragon) Constituent of Artemisia dracunculoides (Russian tarragon). Dracunculin is found in mugwort and pulses.
1-Propenyl 1-(1-propenylthio)propyl disulfide
1-Propenyl 1-(1-propenylthio)propyl disulfide is found in onion-family vegetables. 1-Propenyl 1-(1-propenylthio)propyl disulfide is isolated from the Welsh onion (Allium fistulosum). Isolated from the Welsh onion (Allium fistulosum). 1-Propenyl 1-(1-propenylthio)propyl disulfide is found in onion-family vegetables.
8-Methoxy-6,7-methylenedioxycoumarin
8-Methoxy-6,7-methylenedioxycoumarin is isolated from Artemisia vulgaris (mugwort). Isolated from Artemisia vulgaris (mugwort)
Brassitin
Stress metabolite from Japanese radish Daikon (Raphanus sativus variety hortensis, Cruciferae), inoculated with Pseudomonas cichorii. Brassitin is found in brassicas and root vegetables. Brassitin is found in brassicas. Brassitin is a stress metabolite from Japanese radish Daikon (Raphanus sativus var. hortensis, Cruciferae), inoculated with Pseudomonas cichorii.
Buntansin A
Buntansin A is found in citrus. Buntansin A is a constituent of Citrus grandis (pummelo) Constituent of Citrus grandis (pummelo). Buntansin A is found in citrus.
7-Hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-carboxylic acid
7-Hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-carboxylic acid is found in green vegetables. 7-Hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-carboxylic acid is a constituent of Rheum sp Constituent of Rheum species 7-Hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-carboxylic acid is found in green vegetables.
Dehydroxyzyleuton
Dehydroxyzyleuton is only found in individuals that have used or taken Zileuton. Dehydroxyzyleuton is a metabolite of Zileuton. Dehydroxyzyleuton belongs to the family of Benzothiophenes. These are organic compounds containing a benzene fused to a thiepine ring (a five-member ring with six carbon atoms and one sulfur atom).
Serylaspartic acid
Serylaspartic acid is a dipeptide composed of serine and aspartic acid. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.
3-Hydroxy-3-carboxymethyl-adipic acid
3-Hydroxy-3-carboxymethyl-adipic acid belongs to the family of Tricarboxylic Acids and Derivatives. These are organic compounds containing three carboxylic acid groups (or salt/ester derivatives thereof)
(2R)-2-Amino-3-methyl-3-(2-nitrosoacetyl)sulfanylbutanoic acid
1-Fluoro-3-(2-methylphenyl)uracil
1,9-Pyrazoloanthrone
s-Nitroso-n-acetyl-d-penicillamine
Rapalexin B
Rapalexin b is a member of the class of compounds known as hydroxyindoles. Hydroxyindoles are organic compounds containing an indole moiety that carries a hydroxyl group. Rapalexin b is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Rapalexin b can be found in chinese cabbage, which makes rapalexin b a potential biomarker for the consumption of this food product.
2-(3'-methylthio)propylmalate
2-(3-methylthio)propylmalate, also known as 2-hydroxy-2-[3-(methylsulfanyl)propyl]succinate or 2-(3-methylsulfanyl)propylmalic acid, belongs to medium-chain hydroxy acids and derivatives class of compounds. Those are hydroxy acids with a 6 to 12 carbon atoms long side chain. 2-(3-methylthio)propylmalate is slightly soluble (in water) and a weakly acidic compound (based on its pKa). 2-(3-methylthio)propylmalate can be found in a number of food items such as broad bean, gram bean, sesbania flower, and cherimoya, which makes 2-(3-methylthio)propylmalate a potential biomarker for the consumption of these food products.
3-(3'-methylthio)propylmalate
3-(3-methylthio)propylmalate, also known as 3-(3-methylsulfanyl)propylmalic acid, belongs to medium-chain hydroxy acids and derivatives class of compounds. Those are hydroxy acids with a 6 to 12 carbon atoms long side chain. 3-(3-methylthio)propylmalate is soluble (in water) and a weakly acidic compound (based on its pKa). 3-(3-methylthio)propylmalate can be found in a number of food items such as elderberry, fig, bitter gourd, and potato, which makes 3-(3-methylthio)propylmalate a potential biomarker for the consumption of these food products.
Sodium Danshensu
Danshensu is isolated from the Chinese herb Salvia miltiorrhiza and inhibits CaCl2-induced vasoconstriction. Danshensu is isolated from the Chinese herb Salvia miltiorrhiza and inhibits CaCl2-induced vasoconstriction.
Sodium Danshensu
Danshensu is isolated from the Chinese herb Salvia miltiorrhiza and inhibits CaCl2-induced vasoconstriction. Danshensu is isolated from the Chinese herb Salvia miltiorrhiza and inhibits CaCl2-induced vasoconstriction.
2-(4-Morpholinyl)benzothiazole
CONFIDENCE standard compound; INTERNAL_ID 2877 CONFIDENCE standard compound; INTERNAL_ID 8841
8-Chlro-1-tetrahydronorharmanone
relative retention time with respect to 9-anthracene Carboxylic Acid is 0.962 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.960 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.957
cis,cis-5-Methylmercapto-decadien-(2,4)-diin-(6,8)-saeure-(1)-methylester|cis,cis-5-Methylmercapto-decadien-(2,4)-diin-(6,8)-saeuremethylester
2,5,8-dihydroxy-3-methyl-1,4-naphthoquinone|2,5,8-trihydroxy-3-methyl-1,4-naphthoquinone|2,5,8-trihydroxy-3-methyl-[1,4]naphthoquinone|2-methyl-3,5,8-trihydroxy-1,4-naphthoquinone|3,5,8-trihydroxy-2-methyl-1,4-naphthoquinone|8-hydroxydroserone|hydroxydroserone
7-Methylmercapto-decadien-(2t,6t)-diin-(4,8)-saeure-(1)-methylester|methyl (1E,5Z)-6-(methylthio)-1,5-nonadiene-3,7-diyne carboxylate
(2Z,6E)-3-Chloromethyl-1-chloro-7-methylocta-2,6-dien-8-al|8-Chloro-6-chloromethyl-2-methyl-2, 6-octadienal, 9CI
9-Methylmercapto-decadien-(trans-2,cis-8)-diin-(4,6)-saeure-methylester|cis,trans-9-Methylmercapto-decadien-(2,8)-diin-(4,6)-saeuremethylester|trans,trans-9-Methylmercapto-decadien-(2,8)-diin-(4,6)-saeure-methylester
2-cis,4-trans-4-Methylmercapto-deca-2,4-dien-6,8-diin-saeuremethylester|2-cis,4-trans-4-Methylmercapto-decadien-(2,4)-diin-(6,8)-saeuremethylester|Me ester-(2Z,4Z)-4-Methylthio-2,4-decadiene-6,8-diynoic acid
3-(3-chloroprop-1-yn-1-yl)-3,4-dihydro-1H-isochromen-1-one|gymnopalyne B
8,8a-Dihydro-3-methoxy-5-methyl-1H,6H-furo[3,4-e][1,3,2]dioxaphosphepin 3-oxide
9-Methylmercaptodecatetraen-(2c,6,7,8)-in-(4)-saeuremethylester
(8R,9S)-8-chloro-9-hydroxy-8,9-deoxyaspyrone|chlorohydroaspyrone A
<5-(5-Methyl-2-thienyl)-pent-2t-en-4-inyl>-acetat|[5-(5-Methyl-2-thienyl)-pent-2t-en-4-inyl]-acetat
4-methyl-2-pyridin-4-yl-1,3-thiazole-5-carboxylic Acid
4-Methyl-2-(pyridin-2-yl)thiazole-5-carboxylic acid
dimethyl citrate
Dimethylurea/citric acid is a highly efficient deep eutectic solvent (DES). Dimethylurea/citric acid can be used as a catalyst and a green reaction medium for the synthesis of?bis(indolyl)methanes, quinolines and aryl-4, 5-diphenyl-1H-imidazoles.
3-hydroxy-5-methoxy-3-methoxycarbonyl-5-oxopentanoic acid
Purpurogallin
Purpurogallin is a cyclic ketone that is 5H-benzocycloheptene bearing an oxo group at position 5 and hydroxy groups at positions 2, 3, 4 and 6. It has a role as an antibacterial agent, an antioxidant, an EC 1.17.3.2 (xanthine oxidase) inhibitor and a protective agent. It is a tetrol, a cyclic ketone and a member of phenols. It derives from a hydride of a 5H-benzocycloheptene. Purpurogalline is a natural product found in Quercus with data available. Purpurogallin is a naturally phenol extracted from the plants of Quercus spp, has potent xanthine oxidase (XO) inhibitory activity with an IC50 of 0.2 μM. Purpurogallin has antioxidant and anti-inflammatory effects[1][2][3].
4-methyl-2-(4-pyridinyl)-5-thiazolecarboxylic acid
3-CarboxyMethyl-quinazoline-2,4-dione
2-(2-Thienylmethylene)-1,6-dioxaspiro[4.4]non-3-ene
7-hydroxy-2-methyl-4-oxo-4H-chromene-5-carboxylic acid
1-Propenyl 1-(1-propenylthio)propyl disulfide
5-CHLORO-1-(2-HYDROXY-ETHOXYMETHYL)-1H-PYRIMIDINE-2,4-DIONE
6-methyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
5-Fluoro-6-hydroxy-naphthalene-1-carboxylic acid methyl ester
1-(3-[(3-METHYLPIPERIDIN-1-YL)METHYL]PHENYL)METHANAMINE
SODIUM 2-HYDROXY-2-(4-HYDROXY-3-METHOXYPHENYL)ACETATE
1-(1-methylpyrazol-4-yl)-4-oxopyridazine-3-carboxylic acid
Hydrazinecarbothioamide,2-(1,2-dihydro-2-oxo-3H-indol-3-ylidene)-
Ethyl 4-oxotetrahydro-2H-thiopyran-3-carboxylate 1,1-dioxide
2-Naphthalenecarboxylic acid, 4,6,7-trihydroxy- (9CI)
2-OXO-2-(4-(TRIFLUOROMETHYL)PHENYL)ACETALDEHYDE HYDRATE
7-METHYL-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-4(3H)-ONE
1-(2,6-DIFLUOROBENZYL)-1H-1,2,3-TRIAZOLE-4-CARBONITRILE
2-[methoxy(methylsulfanyl)methylidene]-3H-inden-1-one
3-Hydroxy-3-(2-oxopropyl)-1,3-dihydro-2H-indol-2-one
4-(2-CHLORO-3-PYRIDINYL)-N-METHYL-2-PYRIMIDINAMINE
5-CHLORO-1-METHYL-3-PHENYL-1H-PYRAZOLE-4-CARBALDEHYDE
5-(4-fluorophenyl)-2-methylfuran-3-carboxylic acid
2-Chloro-1,3-Dimethylimidazolidinium Tetrafluoroborate
6-(2-AMINO-PHENYL)-3-THIOXO-3,4-DIHYDRO-2H-[1,2,4]TRIAZIN-5-ONE
3aH-[1,2,4]triazolo[3,4-b][1,3]benzothiazole-3-carboxamide
1-(4-FLUOROPHENYL)-3-METHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID
2-(bromomethyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
2,3,4,5-TETRAHYDRO-1H-BENZO[E][1,4]DIAZEPINE DIHYDROCHLORIDE
1-(4-FLUORO-PHENYL)-3,3-BIS-METHYLSULFANYL-PROPENONE
Methyl 3-amino-5-(trifluoromethyl)pyridine-2-carboxylate
Ethyl 4-oxo-4H-pyrido[3,4-d][1,3]oxazine-2-carboxylate
4-ethyl-2-(trifluoromethyl)pyrimidine-5-carboxylic acid
4-(Methylamino)-3-nitro-1,5-naphthyridin-2(1H)-one
4,6-dimethyl-2-(trifluoromethyl)pyrimidine-5-carboxylic acid
6-Methoxy-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid
5-chloro-3-methyl-1-phenyl-1h-pyrazole-4-carbaldehyde
(4-Chlorophenyl)(1-methyl-1H-imidazol-2-yl)methanone
2-Methoxy-4-(trifluoromethyl)pyridine-3-carboxamide
(3-TERT-BUTOXYCARBONYLAMINO-AZETIDIN-1-YL)-FURAN-2-YL-ACETICACID
ethyl 4-oxopyrido[2,3-d][1,3]oxazine-2-carboxylate
Benzoic acid,2-hydroxy-4-(trifluoromethyl)-, methyl ester
5-Chloro-3-(4,5-dihydro-1H-imidazol-2-yl)-1H-pyrrolo[2,3-b]pyridi ne
1H-Pyrrolo[2,3-b]pyridine-2,5-dicarboxylic acid, 5-Methyl ester
7-HYDROXY-2-OXO-2H-CHROMENE-3-CARBOXYLIC ACID METHYL ESTER
1-(4-BROMOPHENYL)-2-OXOPYRROLIDINE-3-CARBOXYLICACID
1-chloro-5,7-dimethyl-3,4-dihydronaphthalene-2-carbaldehyde
3-(Carboxymethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid
2-(Methoxycarbonyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid
1-Methyl-1H-pyrrolo[2,3-b]pyridine-3,5-dicarboxylic acid
5-Pyrimidinecarboxylicacid,2-ethyl-4-(trifluoromethyl)-(9CI)
3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxylic acid
1-[3-fluoro-4-(trifluoromethyl)phenyl]propan-1-one
1-METHYL-4-PHENYL-1H-IMIDAZOLE-5-CARBONYL CHLORIDE
3-Fluoro-4-(4-methyl-1H-imidazol-1-yl)benzoic acid
2-(4-Fluorophenyl)-5-methyl-1H-imidazole-4-carboxylic acid
4-(METHYLTHIO)-6-PYRAZIN-2-YL-1,3,5-TRIAZIN-2-AMINE
5-(3-FLUOROPHENYL)FURAN-2-CARBOXYLIC ACID METHYL ESTER
5-(4-methoxyphenyl)-1,2,4-oxadiazole-3-carboxylic acid
1-(4-fluorophenyl)-5-methylpyrazole-4-carboxylic acid
3-Methyl-5,6,7,8-tetrahydro-[1,6]naphthyridine dihydrochloride
3H-IMidazo[4,5-b]pyridine-2-MethanaMine (hydrochloride)(1:2)
(R)-5,6,7,8-Tetrahydro-quinolin-8-ylamine dihydrochloride
1(4H)-Pyridinecarbothioamide,4-ethynyl-3,5-diformyl-
5-amino-N,N-dimethyl-1-benzothiophene-2-carboxamide
1,2,3,4-tetrahydroisoquinolin-4-amine,dihydrochloride
1-(4-CHLOROPHENYL)-2-(1H-IMIDAZOL-1-YL)-1-ETHANONE
1-Methyl-1,2,3,4-tetrahydroquinoxaline dihydrochloride
7-CHLORO-2,3-DIHYDROPYRROLO[2,1-B]QUINAZOLIN-9(1H)-ONE
2-AMINODIPYRIDO[1,2-A:3,2-D]IMIDAZOLE, HYDROCHLORIDE
1-[4-fluoro-3-(trifluoromethyl)phenyl]propan-1-one
4-METHYL-2-OXO-6-(TRIFLUOROMETHYL)-1,2-DIHYDROPYRIDINE-3-CARBOXAMIDE
N-Acetyl-3-(nitrososulfanyl)valine
D006401 - Hematologic Agents > D010975 - Platelet Aggregation Inhibitors > D026403 - S-Nitrosothiols D002317 - Cardiovascular Agents > D020030 - Nitric Oxide Donors D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents D004791 - Enzyme Inhibitors
Phenol, 4-(2,3,5,6-tetrahydroimidazo[2,1-b]thiazol-6-yl)-
S-Nitroso-N-acetylpenicillamine
D006401 - Hematologic Agents > D010975 - Platelet Aggregation Inhibitors > D026403 - S-Nitrosothiols D002317 - Cardiovascular Agents > D020030 - Nitric Oxide Donors D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents D004791 - Enzyme Inhibitors
Tyrphostin 47
D000970 - Antineoplastic Agents > D020032 - Tyrphostins D004791 - Enzyme Inhibitors
2,6,7-Trihydroxy-3-methylnaphthalene-1,4-dione
A naphthoquinone that is naphthalene-1,4-dione substituted by hydroxy groups at positions 2, 6 and 7 and a methyl group at position 3. It has been isolated from Penicillium purpurogenum.
aldioxa
C78284 - Agent Affecting Integumentary System > C29700 - Astringent D005765 - Gastrointestinal Agents > D000863 - Antacids D003879 - Dermatologic Agents > D001252 - Astringents
8-Chloro-2,3,4,9-tetrahydro-1h-beta-carbolin-1-one
2-hydroxy-3-[3-(methylsulfanyl)propyl]butanedioate
L-histidinol phosphate(1-)
Conjugate base of L-histidinol phosphate having an anionic phosphate and a catoinic amino group; major species at pH 7.3.
(Z)-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enethioamide
D000970 - Antineoplastic Agents > D020032 - Tyrphostins D004791 - Enzyme Inhibitors
(5E)-5-(4-hydroxybenzylidene)-2-imino-1,3-thiazolidin-4-one
Z-5-(4-Hydroxybenzylidene)-2-imino-1,3-thiazolidin-4-one
2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-3-carboxylic acid
alpha-Keto-gamma-(methylthio)butyric acid, trimethylsilyl ester
canthinone
Canthin-6-one is an indole alkaloid that is 6H-indolo[3,2,1-de][1,5]naphthyridine substituted by an oxo group at position 6. It has a role as a metabolite and an antimycobacterial drug. It is an indole alkaloid, an organic heterotetracyclic compound and an enone. Canthin-6-one is a natural product found in Zanthoxylum mayu, Zanthoxylum ovalifolium, and other organisms with data available. An indole alkaloid that is 6H-indolo[3,2,1-de][1,5]naphthyridine substituted by an oxo group at position 6. D016573 - Agrochemicals D010575 - Pesticides Canthin-6-one displays a wide range of biological activities, such as antimycobacterial activity[1]. Canthin-6-one displays a wide range of biological activities, such as antimycobacterial activity[1].
7-Hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-carboxylic acid
3-(Imidazol-4-yl)-2-oxopropyl dihydrogen phosphate
9-chloro-2,10-dioxatricyclo[5.3.1.0⁴,¹¹]undecane-4,5-diol
(5s,6r)-3-[(1s,2s)-2-chloro-1-hydroxypropyl]-5-hydroxy-6-methyl-5,6-dihydropyran-2-one
3-(1-chloro-2-hydroxypropyl)-5-(1-hydroxyethyl)-5h-furan-2-one
(2s,3r)-2-[(1e)-4-(thiophen-2-yl)but-1-en-3-yn-1-yl]oxolan-3-ol
methyl (2e,6z)-7-(methylsulfanyl)deca-2,6-dien-4,8-diynoate
3-(2-chloro-1-hydroxypropyl)-5-(1-hydroxyethyl)-5h-furan-2-one
2-hydroxy-l,2,3-propanetricarboxylicacid-1,3-dimethylester
{"Ingredient_id": "HBIN005807","Ingredient_name": "2-hydroxy-l,2,3-propanetricarboxylicacid-1,3-dimethylester","Alias": "NA","Ingredient_formula": "C8H12O7","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10661","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
5-carboxy-7-hydroxy-2-methyl-benzopyran-γ-one
{"Ingredient_id": "HBIN011488","Ingredient_name": "5-carboxy-7-hydroxy-2-methyl-benzopyran-\u03b3-one","Alias": "NA","Ingredient_formula": "C11H8O5","Ingredient_Smile": "CC1=CC(=O)C2=C(O1)C=C(C=C2C(=O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14578","TCMID_id": "3173","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
