Exact Mass: 402.0558

Exact Mass Matches: 402.0558

Found 230 metabolites which its exact mass value is equals to given mass value 402.0558, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

dTDP

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

C10H16N2O11P2 (402.0229)


Is an intermediate in the Thymidylate kinase (EC 2.7.4.9; ATP:dTMP phosphotransferase) catalyzes the phosphorylation of dTMP (to form dTDP) in the dTTP synthesis pathway for DNA synthesis. (OMIM 188345 ) [HMDB]. dTDP is found in many foods, some of which are bog bilberry, poppy, garden tomato, and chanterelle. Is an intermediate in the Thymidylate kinase (EC 2.7.4.9; ATP:dTMP phosphotransferase) catalyzes the phosphorylation of dTMP (to form dTDP) in the dTTP synthesis pathway for DNA synthesis. (OMIM 188345 ) Acquisition and generation of the data is financially supported in part by CREST/JST. D000890 - Anti-Infective Agents > D000998 - Antiviral Agents D000970 - Antineoplastic Agents

   
   

4'-Phosphopantothenoylcysteine

(2R)-2-{3-[(2R)-2-hydroxy-3-methyl-3-[(phosphonooxy)methyl]butanamido]propanamido}-3-sulfanylpropanoic acid

C12H23N2O9PS (402.0862)


4-Phosphopantothenoylcysteine, also known as pantothenoylcysteine 4-phosphate, belongs to the class of organic compounds known as hybrid peptides. Hybrid peptides are compounds containing at least two different types of amino acids (alpha, beta, gamma, delta) linked to each other through a peptide bond. 4-Phosphopantothenoylcysteine is an extremely weak basic (essentially neutral) compound (based on its pKa). Within humans, 4-phosphopantothenoylcysteine participates in a number of enzymatic reactions. In particular, cytidine monophosphate and 4-phosphopantothenoylcysteine can be biosynthesized from cytidine triphosphate, D-4-phosphopantothenate, and L-cysteine through the action of the enzyme phosphopantothenate--cysteine ligase. 4-Phosphopantothenoylcysteine (PPC) is an intermediate in the biosynthetic machinery (pathway) that converts pantothenate (vitamin B5) into coenzyme A (CoA). The enzyme phosphopantothenoylcysteine decarboxylase catalyzes the decarboxylation of PPC into 4-phosphopantetheine. Coenzyme A is the principal acyl carrier and is required for many synthetic and degradative reactions in intermediary metabolism, and is an essential cofactor in all living systems (PMID: 15450493, 16371361, 14501115). 4-Phosphopantothenoylcysteine (PPC) is an intermediate in the biosynthetic machinery (pathway) that converts pantothenate (vitamin B5) into coenzyme A (CoA). The enzyme Phosphopantothenoylcysteine decarboxylase catalyzes the decarboxylation of PPC to 4-phosphopantetheine. Coenzyme A is the principal acyl carrier and is required for many synthetic and degradative reactions in intermediary metabolism, and is an essential cofactor in all living systems. (PMID: 15450493, 16371361, 14501115) [HMDB]

   

1-Hydroxy-2-(beta-D-glucosyloxy)-9,10-anthraquinone

1,2-dihydroxy-9,10-anthraquinone 2-O-beta-D-glucopyranoside;1-hydroxy-2-(beta-D-glucosyloxy)-9,10-anthraquinone;1-hydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl beta-D-glucopyranoside;2-(beta-D-glucopyranosyloxy)-1-hydroxy-9,10-anthracenedione;2-alizarin-beta-D-glucoside;alizarin-2-beta-D-glucopyranoside

C20H18O9 (402.0951)


   

Frangulin B

Frangulin B

C20H18O9 (402.0951)


   

Versiconol acetate

(3S)-versiconol acetate

C20H18O9 (402.0951)


An acetate ester that is the O-acetyl derivative of versiconol. An intermediate in the biosynthesis of aflatoxin.

   

Cytidine diphosphoramidate

Cytidine diphosphoramidate

C9H16N4O10P2 (402.0342)


   

Apigenin-C-pentoside

Apigenin-C-pentoside

C20H18O9 (402.0951)


   

Shoyuflavone B

2-hydroxy-3-{[5-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}butanedioic acid

C19H14O10 (402.0587)


Shoyuflavone B is found in herbs and spices. Shoyuflavone B is isolated from fermented soy sauce. Shoyuflavone B is produced by Aspergillus oryza Isolated from fermented soy sauce. Production by Aspergillus oryzae. Shoyuflavone B is found in herbs and spices.

   

Mollicellin J

Mollicellin J

C21H19ClO6 (402.087)


   

5-Hydroxy-3,3',7,8-tetramethoxy-4',5'-methylenedioxyflavone

3-hydroxy-5,7,8-trimethoxy-2-(7-methoxy-2H-1,3-benzodioxol-5-yl)-4H-chromen-4-one

C20H18O9 (402.0951)


5-Hydroxy-3,3,7,8-tetramethoxy-4,5-methylenedioxyflavone is found in citrus. 5-Hydroxy-3,3,7,8-tetramethoxy-4,5-methylenedioxyflavone is a constituent of the dried fruit of Citrus reticulata (mandarin). Constituent of the dried fruit of Citrus reticulata (mandarin). 5-Hydroxy-3,3,7,8-tetramethoxy-4,5-methylenedioxyflavone is found in citrus.

   

N-(Cyclopropylmethoxy)-N-(3,5-dichloropyridin-4-yl)-4-(difluoromethoxy)benzamide

N-(Cyclopropylmethoxy)-N-(3,5-dichloropyridin-4-yl)-4-(difluoromethoxy)benzamide

C17H14Cl2F2N2O3 (402.0349)


   

2,7-Dichlorofluorescin

2-(2,7-dichloro-3,6-dihydroxy-9H-xanthen-9-yl)benzoic acid

C20H12Cl2O5 (402.0062)


   

dichlorodihydrofluorescein

1,2-dichloro-3,6-dihydroxy-1,2-dihydro-3H-spiro[2-benzofuran-1,9-xanthene]-3-one

C20H12Cl2O5 (402.0062)


   

Dichlorofluorescin

2-(1,2-dichloro-3,6-dihydroxy-9H-xanthen-9-yl)benzoic acid

C20H12Cl2O5 (402.0062)


D004396 - Coloring Agents > D005456 - Fluorescent Dyes > D005452 - Fluoresceins

   

Pritelivir

N-(5-(Aminiosulfonyl)-4-methyl-1,3-thiazol-2-yl)-N-methyl-2-(4-(2-pyridinyl)phenyl)acetamide

C18H18N4O3S2 (402.082)


D000890 - Anti-Infective Agents > D000998 - Antiviral Agents C254 - Anti-Infective Agent > C281 - Antiviral Agent D004791 - Enzyme Inhibitors

   

Roflumilast

3-(cyclopropylmethoxy)-N-(3,5-dichloropyridin-4-yl)-4-(difluoromethoxy)benzamide

C17H14Cl2F2N2O3 (402.0349)


R - Respiratory system > R03 - Drugs for obstructive airway diseases C471 - Enzyme Inhibitor > C744 - Phosphodiesterase Inhibitor

   

7,7a-Dichloro-3',6'-dihydroxyspiro[7H-2-benzofuran-3,9'-xanthene]-1-one

3a,4-dichloro-3,6-dihydroxy-3a,4-dihydro-3H-spiro[2-benzofuran-1,9-xanthene]-3-one

C20H12Cl2O5 (402.0062)


   

Psoberan

4-methoxy-7H-furo[3,2-g]chromen-7-one; 7H-furo[3,2-g]chromen-7-one

C23H14O7 (402.0739)


Psoberan can be found in fig, which makes psoberan a potential biomarker for the consumption of this food product. D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins

   

Apigenin 7-arabinoside

5-hydroxy-2-(4-hydroxyphenyl)-7-[(3,4,5-trihydroxyoxan-2-yl)oxy]-4H-chromen-4-one

C20H18O9 (402.0951)


Apigenin 7-arabinoside is a member of the class of compounds known as flavonoid-7-o-glycosides. Flavonoid-7-o-glycosides are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C7-position. Apigenin 7-arabinoside is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Apigenin 7-arabinoside can be found in chicory, which makes apigenin 7-arabinoside a potential biomarker for the consumption of this food product.

   

Apigenin 7-xyloside

5,7,4-Trihydroxyflavone 7-xyloside

C20H18O9 (402.0951)


   

Mollupentin

8-alpha-L-Arabinopyranosyl-5,7-dihydroxy-2- (4-hydroxyphenyl) -4H-1-benzopyran-4-one

C20H18O9 (402.0951)


   

Cerarvensin

5,7-Dihydroxy-2- (4-hydroxyphenyl) -6-beta-D-xylopyranosyl-4H-1-benzopyran-4-one

C20H18O9 (402.0951)


   

beta-isorhodomycinone

[7R-(7alpha,8beta,10beta)]-8-Ethyl-7,8,9,10-tetrahydro-1,4,6,7,8,10,11-heptahydroxy-5,12-naphthacenedione

C20H18O9 (402.0951)


   

5,2,5-Trihydroxy-3,7,8-trimethoxyflavone 2-acetate

5,2,5-Trihydroxy-3,7,8-trimethoxyflavone 2-acetate

C20H18O9 (402.0951)


   

Gossypetin 3,7,3-trimethyl ether 8-acetate

Gossypetin 3,7,3-trimethyl ether 8-acetate

C20H18O9 (402.0951)


   

Isomollupentin

6-alpha-L-Arabinopyranosyl-5,7-dihydroxy-2- (4-hydroxyphenyl) -4H-1-benzopyran-4-one

C20H18O9 (402.0951)


   

5-Demethylmelibentin

2- (1,3-Benzodioxol-5-yl) -5-hydroxy-3,6,7,8-tetramethoxy-4H-1-benzopyran-4-one

C20H18O9 (402.0951)


   

2-(1,3-Benzodioxol-5-yl)-7-hydroxy-3,5,6,8-tetramethoxy-4H-1-benzopyran-4-one

2-(1,3-Benzodioxol-5-yl)-7-hydroxy-3,5,6,8-tetramethoxy-4H-1-benzopyran-4-one

C20H18O9 (402.0951)


   

7-Hydroxy-5,6,8,3-tetramethoxy-4,5-methylenedioxyflavone

7-Hydroxy-5,6,8,3-tetramethoxy-4,5-methylenedioxyflavone

C20H18O9 (402.0951)


   
   

MCULE-9857824837

MCULE-9857824837

C21H19ClO6 (402.087)


   
   
   

Ethyl 2-cyano-3-[(2-ethoxy-2-oxoethyl)sulfanyl]-3-[2-(trifluoromethyl)anilino]acrylate

Ethyl 2-cyano-3-[(2-ethoxy-2-oxoethyl)sulfanyl]-3-[2-(trifluoromethyl)anilino]acrylate

C17H17F3N2O4S (402.0861)


   
   
   
   

Cyanidin 3-O-arabinopyranoside

Cyanidin 3-O-arabinopyranoside

C20H18O9 (402.0951)


   

MCULE-4495199001

MCULE-4495199001

C21H19ClO6 (402.087)


   
   
   
   

4,6-Diformyl-8-hydroxy-9-hydroxymethyl-3-methoxy-1-methyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carbonsaeure|4,6-diformyl-8-hydroxy-9-hydroxymethyl-3-methoxy-1-methyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carboxylic acid

4,6-Diformyl-8-hydroxy-9-hydroxymethyl-3-methoxy-1-methyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carbonsaeure|4,6-diformyl-8-hydroxy-9-hydroxymethyl-3-methoxy-1-methyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carboxylic acid

C19H14O10 (402.0587)


   

5,3,4,5-Tetramethoxy-6,7-methylenedioxyisoflavone

5,3,4,5-Tetramethoxy-6,7-methylenedioxyisoflavone

C20H18O9 (402.0951)


   

2,3,6-tricarboxy-6,7-dihydroxy-1(3)-2-pyranonyl-1,2-dihydronaphthalene-10-methyl ester

2,3,6-tricarboxy-6,7-dihydroxy-1(3)-2-pyranonyl-1,2-dihydronaphthalene-10-methyl ester

C19H14O10 (402.0587)


   

Constictic acid

Constictic acid

C19H14O10 (402.0587)


   

kaempferol-3-alpha-arabinopyranoside

kaempferol-3-alpha-arabinopyranoside

C20H18O9 (402.0951)


   

3,7,8-Tri-Me ether,2-Ac-2,3,5,5,7,8-Hexahydroxyflavone|5,5-dihydroxy-3,7,8-trimethoxy-2-acetoxyflavone

3,7,8-Tri-Me ether,2-Ac-2,3,5,5,7,8-Hexahydroxyflavone|5,5-dihydroxy-3,7,8-trimethoxy-2-acetoxyflavone

C20H18O9 (402.0951)


   

2,3,6-tricarboxy-6,7-dihydroxy-1(3)-2-pyranonyl-1,2-dihydronaphthalene-9-methyl ester

2,3,6-tricarboxy-6,7-dihydroxy-1(3)-2-pyranonyl-1,2-dihydronaphthalene-9-methyl ester

C19H14O10 (402.0587)


   

(+)-variecolorquinones A

(+)-variecolorquinones A

C20H18O9 (402.0951)


   

1-(alpha-Hydroxybenzyl)-3,7-dihydroxy-8-methoxy-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid 2,1-lactone

1-(alpha-Hydroxybenzyl)-3,7-dihydroxy-8-methoxy-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid 2,1-lactone

C23H14O7 (402.0739)


   
   

Peristictic acid

Peristictic acid

C19H14O10 (402.0587)


   

Apigenin 6-C-pentoside

Apigenin 6-C-pentoside

C20H18O9 (402.0951)


   
   

4,6-Diformyl-3,8-dihydroxy-9-methoxymethyl-1-methyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carbonsaeure|4,6-diformyl-3,8-dihydroxy-9-methoxymethyl-1-methyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carboxylic acid

4,6-Diformyl-3,8-dihydroxy-9-methoxymethyl-1-methyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carbonsaeure|4,6-diformyl-3,8-dihydroxy-9-methoxymethyl-1-methyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carboxylic acid

C19H14O10 (402.0587)


   

7,8-dihydro-7-(3-methoxy-4,5-dihydroxyphenyl)-8-(hydroxymethyl)-6-methoxy-2H-pyrano[2,3-f]-7,8-benzodioxin-2-one|malloapelin C

7,8-dihydro-7-(3-methoxy-4,5-dihydroxyphenyl)-8-(hydroxymethyl)-6-methoxy-2H-pyrano[2,3-f]-7,8-benzodioxin-2-one|malloapelin C

C20H18O9 (402.0951)


   

Demethylaquilochin

Demethylaquilochin

C20H18O9 (402.0951)


   

6-C-alpha-arabinofuranosylapigenin|apigenin 6-C-alpha-arabinofuranoside

6-C-alpha-arabinofuranosylapigenin|apigenin 6-C-alpha-arabinofuranoside

C20H18O9 (402.0951)


   

1-hydroxy-2-(3,4-methylenedioxy)phenoxy-6-(2-hydroxy-3,4-methylenedioxy)phenyl-3,7-dioxabicyclo[3.3.0]octane|phrymarolin B|phrymarolin III|rel-(1R,3aR,4S,6aS)-4-(1,3-benzodioxol-5-yloxy)dihydro-1-(4-hydroxy-1,3-benzodioxol-5-yl)-1H,3H-furo[3,4-c]furan-3a(4H)-ol

1-hydroxy-2-(3,4-methylenedioxy)phenoxy-6-(2-hydroxy-3,4-methylenedioxy)phenyl-3,7-dioxabicyclo[3.3.0]octane|phrymarolin B|phrymarolin III|rel-(1R,3aR,4S,6aS)-4-(1,3-benzodioxol-5-yloxy)dihydro-1-(4-hydroxy-1,3-benzodioxol-5-yl)-1H,3H-furo[3,4-c]furan-3a(4H)-ol

C20H18O9 (402.0951)


   

3,4,4,5-tetrahydroxy-3-methoxypulvinic acid|retiboletic acid

3,4,4,5-tetrahydroxy-3-methoxypulvinic acid|retiboletic acid

C19H14O10 (402.0587)


   

Cetraric acid

Cetraric acid

C20H18O9 (402.0951)


   

2,6-dihydroxyanthraquinone 2-beta-D-glucopyranoside

2,6-dihydroxyanthraquinone 2-beta-D-glucopyranoside

C20H18O9 (402.0951)


   

erimopyrone 9-methyl ester

erimopyrone 9-methyl ester

C19H14O10 (402.0587)


   

Integrastatin B

Integrastatin B

C20H18O9 (402.0951)


An organic heterotetracyclic compound that is 11,12-dihydro-6H-6,12-epoxydibenzo[b,f]oxocine substituted by hydroxy groups at positions 4, 7 and 8, methoxy groups at positions 3 and 9, methyl groups at positions 6 and 12, an oxo group at position 11 and a formyl group at position 1. It is isolated as a racemate from Ascochyta and exhibits inhibitory activity against HIV-1 integrase.

   

Xanthopurpurin-3-O-??-D-glucoside

Xanthopurpurin-3-O-??-D-glucoside

C20H18O9 (402.0951)


   

3,4,5,5-O-Tetramethyl-3,4-O,O-methylidenecoruleoellagic acid d

3,4,5,5-O-Tetramethyl-3,4-O,O-methylidenecoruleoellagic acid d

C19H14O10 (402.0587)


   

Pipoxide chlorohydrin

Pipoxide chlorohydrin

C21H19ClO6 (402.087)


   

Roflumilast

Roflumilast (Daxas)

C17H14Cl2F2N2O3 (402.0349)


R - Respiratory system > R03 - Drugs for obstructive airway diseases C471 - Enzyme Inhibitor > C744 - Phosphodiesterase Inhibitor

   

Thymidine-5-diphosphate sodium salt

Thymidine-5-diphosphate sodium salt

C10H16N2O11P2 (402.0229)


   

C21H19ClO6_[5-(Benzoyloxy)-3-chloro-4,6-dihydroxy-1-cyclohexen-1-yl]methyl benzoate

NCGC00381300-01_C21H19ClO6_[5-(Benzoyloxy)-3-chloro-4,6-dihydroxy-1-cyclohexen-1-yl]methyl benzoate

C21H19ClO6 (402.087)


   

(5-benzoyloxy-3-chloro-4,6-dihydroxycyclohexen-1-yl)methyl benzoate

(5-benzoyloxy-3-chloro-4,6-dihydroxycyclohexen-1-yl)methyl benzoate

C21H19ClO6 (402.087)


   

(5-benzoyloxy-2-chloro-1,6-dihydroxycyclohex-3-en-1-yl)methyl benzoate

(5-benzoyloxy-2-chloro-1,6-dihydroxycyclohex-3-en-1-yl)methyl benzoate

C21H19ClO6 (402.087)


   
   
   
   

Hydroxylated discorhabdin V

Hydroxylated discorhabdin V

[C18H17BrN3O3]+ (402.0453)


   

Ticarcillin penicilloate

Ticarcillin penicilloate

C15H18N2O7S2 (402.0555)


   

Pelargonidin 3-arabinoside

Pelargonidin 3-arabinoside

C20H18O9 (402.0951)


   
   

4-Phospho-N-pantothenoylcysteine

4-Phospho-N-pantothenoylcysteine

C12H23N2O9PS (402.0862)


   

4-O-Demethyl-13-dihydroadriamycinone

4-O-Demethyl-13-dihydroadriamycinone

C20H18O9 (402.0951)


   

Shoyuflavone B

2-hydroxy-3-{[5-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}butanedioic acid

C19H14O10 (402.0587)


   

5-Hydroxy-3,3',7,8-tetramethoxy-4',5'-methylenedioxyflavone

3-hydroxy-5,7,8-trimethoxy-2-(7-methoxy-2H-1,3-benzodioxol-5-yl)-4H-chromen-4-one

C20H18O9 (402.0951)


   

Aspergillusether F

Aspergillusether F

C18H17O4Cl3 (402.0192)


   

(OCTAHYDRO-INDOLIZIN-8-YL)-METHANOL

(OCTAHYDRO-INDOLIZIN-8-YL)-METHANOL

C18H26Cl2Zr (402.0459)


   

ethylene di(thiotosylate)

ethylene di(thiotosylate)

C16H18O4S4 (402.0088)


   
   

2,4-Pentanedione - ruthenium (3:1)

2,4-Pentanedione - ruthenium (3:1)

C15H24O6Ru (402.0616)


   

1-TERT-BUTYL 3-METHYL 5-IODO-1H-INDAZOLE-1,3-DICARBOXYLATE

1-TERT-BUTYL 3-METHYL 5-IODO-1H-INDAZOLE-1,3-DICARBOXYLATE

C14H15IN2O4 (402.0077)


   

Bis(1-propyl-3-methylcyclopentadienyl)zirconium dichloride

Bis(1-propyl-3-methylcyclopentadienyl)zirconium dichloride

C18H26Cl2Zr (402.0459)


   
   

bis(tert-butylcyclopentadienyl)zirconium dichloride

bis(tert-butylcyclopentadienyl)zirconium dichloride

C18H26Cl2Zr (402.0459)


   

phenethicillin potassium

phenethicillin potassium

C17H19KN2O5S (402.0652)


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 C254 - Anti-Infective Agent > C258 - Antibiotic > C260 - Beta-Lactam Antibiotic

   

Methicillin SodiuM

Methicillin SodiuM

C17H19N2NaO6S (402.0861)


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

   

4-Biphenylyl diphenyl phosphate

4-Biphenylyl diphenyl phosphate

C24H19O4P (402.1021)


   

2-Biphenylyl diphenyl phosphate suppliers in China

2-Biphenylyl diphenyl phosphate suppliers in China

C24H19O4P (402.1021)


   

5-O-CARBOMETHOXY-1,2-O-ISO-PROPYLIDENE-3-O-(P-TOLYL-SULFONYL)-ALPHA-D-XYLOFURANOSE

5-O-CARBOMETHOXY-1,2-O-ISO-PROPYLIDENE-3-O-(P-TOLYL-SULFONYL)-ALPHA-D-XYLOFURANOSE

C17H22O9S (402.0984)


   

(1R,2S)-1-Amino-N-(cyclopropylsulfonyl)-2-ethenylcyclopropanecarboxamide 4-methylbenzenesulfonate

(1R,2S)-1-Amino-N-(cyclopropylsulfonyl)-2-ethenylcyclopropanecarboxamide 4-methylbenzenesulfonate

C16H22N2O6S2 (402.0919)


   

ETHYL 4-(4-(2-BROMOBENZYL)PIPERAZIN-1-YL)BENZOATE

ETHYL 4-(4-(2-BROMOBENZYL)PIPERAZIN-1-YL)BENZOATE

C20H23BrN2O2 (402.0943)


   

4-[(4-Chlorophenyl) phenylmethyl]-piperidine dihydrochloride

4-[(4-Chlorophenyl) phenylmethyl]-piperidine dihydrochloride

C19H25Cl3N2O (402.1032)


   

5-(2-BENZOTHIAZOLYL)-1-(4-NITROPHENYL)-3-PHENYLFORMAZAN

5-(2-BENZOTHIAZOLYL)-1-(4-NITROPHENYL)-3-PHENYLFORMAZAN

C20H14N6O2S (402.0899)


   

4,4-SULFONYLBIS(PHENOXYBENZENE)

4,4-SULFONYLBIS(PHENOXYBENZENE)

C24H18O4S (402.0926)


   

Chloro(1,3-dimesitylimidazol-2-ylidene)copper(I)

Chloro(1,3-dimesitylimidazol-2-ylidene)copper(I)

C21H24ClCuN2 (402.0924)


   

1-(2-BROMOPHENYL)-5-ETHYL-3,4-DIPHENYL-1H-PYRAZOLE

1-(2-BROMOPHENYL)-5-ETHYL-3,4-DIPHENYL-1H-PYRAZOLE

C23H19BrN2 (402.0732)


   

1-(4-chlorophenyl)sulfanyl-4-[ethoxy(propylsulfanyl)phosphoryl]oxybenzene

1-(4-chlorophenyl)sulfanyl-4-[ethoxy(propylsulfanyl)phosphoryl]oxybenzene

C17H20ClO3PS2 (402.028)


   

disodium,5-[2-(1,4,6,9-tetraoxa-5-silanuidaspiro[4.4]nonan-5-yloxy)ethoxy]-1,4,6,9-tetraoxa-5-silanuidaspiro[4.4]nonane

disodium,5-[2-(1,4,6,9-tetraoxa-5-silanuidaspiro[4.4]nonan-5-yloxy)ethoxy]-1,4,6,9-tetraoxa-5-silanuidaspiro[4.4]nonane

C10H20Na2O10Si2 (402.039)


   

5-Demethylaquillochin

5-Demethylaquillochin

C20H18O9 (402.0951)


   

1-O-tert-butyl 5-O-methyl 3-iodoindazole-1,5-dicarboxylate

1-O-tert-butyl 5-O-methyl 3-iodoindazole-1,5-dicarboxylate

C14H15IN2O4 (402.0077)


   

(2S,4R)-2-METHYL 1-(4-NITROBENZYL) 4-((METHYLSULFONYL)OXY)PYRROLIDINE-1,2-DICARBOXYLATE

(2S,4R)-2-METHYL 1-(4-NITROBENZYL) 4-((METHYLSULFONYL)OXY)PYRROLIDINE-1,2-DICARBOXYLATE

C15H18N2O9S (402.0733)


   

1-ETHYL-3-METHYLPYRIDINIUM BIS(TRIFLUOROMETHANESULFONYL)IMIDE

1-ETHYL-3-METHYLPYRIDINIUM BIS(TRIFLUOROMETHANESULFONYL)IMIDE

C10H12F6N2O4S2 (402.0143)


   

2,3-BIS(3-CHLOROPHENYL)-5-PHENYLTETRAZOLIUM CHLORIDE

2,3-BIS(3-CHLOROPHENYL)-5-PHENYLTETRAZOLIUM CHLORIDE

C19H13Cl3N4 (402.0206)


   

2,3-BIS(4-CHLOROPHENYL)-5-PHENYLTETRAZOLIUM CHLORIDE

2,3-BIS(4-CHLOROPHENYL)-5-PHENYLTETRAZOLIUM CHLORIDE

C19H13Cl3N4 (402.0206)


   

2,5-Bis(hexyl)-1,4-dibromobenzene

2,5-Bis(hexyl)-1,4-dibromobenzene

C18H28Br2 (402.0558)


   
   

Methanesulfonic acid, 1,1,1-trifluoro-, 2-chloro-3-[4-(2-methoxyethyl)-1-piperazinyl]phenyl ester

Methanesulfonic acid, 1,1,1-trifluoro-, 2-chloro-3-[4-(2-methoxyethyl)-1-piperazinyl]phenyl ester

C14H18ClF3N2O4S (402.0628)


   

Bis(n-butylcyclopentadienyl)zirconium dichloride

Bis(n-butylcyclopentadienyl)zirconium dichloride

C18H26Cl2Zr (402.0459)


   

Aspirin Aluminum

Aspirin Aluminum

C18H15AlO9 (402.0531)


   

1 1-bis(diphenylphosphino)ferrocene

1 1-bis(diphenylphosphino)ferrocene

C22H20FeP2 (402.039)


   

4-(Cyclopropylmethoxy)-3-(difluoromethoxy) Roflumilast

4-(Cyclopropylmethoxy)-3-(difluoromethoxy) Roflumilast

C17H14Cl2F2N2O3 (402.0349)


   

1,2,3,5-tetramethylcyclopenta-1,3-diene,zirconium(4+),dichloride

1,2,3,5-tetramethylcyclopenta-1,3-diene,zirconium(4+),dichloride

C18H26Cl2Zr (402.0459)


   

Hydroquinone diphthalic anhydride

Hydroquinone diphthalic anhydride

C22H10O8 (402.0376)


   

(S)-5-(((4-((5-Chloropyridin-2-yl)oxy)piperidin-1-yl)sulfonyl)methyl)-5-methylimidazolidine-2,4-dione

(S)-5-(((4-((5-Chloropyridin-2-yl)oxy)piperidin-1-yl)sulfonyl)methyl)-5-methylimidazolidine-2,4-dione

C15H19ClN4O5S (402.0765)


   
   
   

Thymidine-3,5-diphosphate

Thymidine-3,5-diphosphate

C10H16N2O11P2 (402.0229)


   

S-3-(4-Fluorophenoxy)-2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide

S-3-(4-Fluorophenoxy)-2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide

C17H14F4N2O5 (402.0839)


   

Parconazole hydrochloride

Parconazole hydrochloride

C17H17Cl3N2O3 (402.0305)


C254 - Anti-Infective Agent > C514 - Antifungal Agent

   

2,7-Dichlorodihydrofluorescein

2,7-Dichlorodihydrofluorescein

C20H12Cl2O5 (402.0062)


D004396 - Coloring Agents > D005456 - Fluorescent Dyes > D005452 - Fluoresceins

   

4-[(3-Chlorophenyl)hydrazinylidene]-3-(4-nitrophenyl)-5-oxo-1-pyrazolecarbothioamide

4-[(3-Chlorophenyl)hydrazinylidene]-3-(4-nitrophenyl)-5-oxo-1-pyrazolecarbothioamide

C16H11ClN6O3S (402.0302)


   

N-((E)-{4-[(2-chloro-1,3-thiazol-5-yl)methoxy]-3-methoxyphenyl}methylidene)isonicotinohydrazide

N-((E)-{4-[(2-chloro-1,3-thiazol-5-yl)methoxy]-3-methoxyphenyl}methylidene)isonicotinohydrazide

C18H15ClN4O3S (402.0553)


   

2-[[1-(4-Methoxy-2-nitrophenyl)-2,5-dioxo-3-pyrrolidinyl]thio]benzoic acid

2-[[1-(4-Methoxy-2-nitrophenyl)-2,5-dioxo-3-pyrrolidinyl]thio]benzoic acid

C18H14N2O7S (402.0522)


   

(1S,6alpha)-1-(Benzoyloxy)methyl-6-chloro-4-cyclohexene-1beta,2beta,3alpha-triol 3-benzoate

(1S,6alpha)-1-(Benzoyloxy)methyl-6-chloro-4-cyclohexene-1beta,2beta,3alpha-triol 3-benzoate

C21H19ClO6 (402.087)


   

(2s)-N-[(3s)-1-(2-Amino-2-Oxoethyl)-2-Oxo-1,2,3,4-Tetrahydroquinolin-3-Yl]-2-Chloro-2h-Thieno[2,3-B]pyrrole-5-Carboxamide

(2s)-N-[(3s)-1-(2-Amino-2-Oxoethyl)-2-Oxo-1,2,3,4-Tetrahydroquinolin-3-Yl]-2-Chloro-2h-Thieno[2,3-B]pyrrole-5-Carboxamide

C18H15ClN4O3S (402.0553)


   

2,5-Bis(2-chloro-4-guanidinophenyl)furan

2,5-Bis(2-chloro-4-guanidinophenyl)furan

C18H16Cl2N6O (402.0763)


   

acs.jmedchem.1c00409_ST.421

acs.jmedchem.1c00409_ST.421

C18H16Cl2N6O (402.0763)


   

5-chloro-6-methyl-N-[2-(4-methylsulfonylphenyl)ethyl]-2-pyridin-2-ylpyrimidin-4-amine

5-chloro-6-methyl-N-[2-(4-methylsulfonylphenyl)ethyl]-2-pyridin-2-ylpyrimidin-4-amine

C19H19ClN4O2S (402.0917)


   

Apigenin 7-arabinoside

Apigenin 7-arabinoside

C20H18O9 (402.0951)


   

5,7-Dihydroxy-2-(4-hydroxyphenyl)-8-(3,4,5-trihydroxyoxan-2-yl)chromen-4-one

5,7-Dihydroxy-2-(4-hydroxyphenyl)-8-(3,4,5-trihydroxyoxan-2-yl)chromen-4-one

C20H18O9 (402.0951)


   
   

propanoyl-AMP(1-)

propanoyl-AMP(1-)

C13H17N5O8P- (402.0815)


An organophosphate oxoanion obtained by removal of the proton from the phosphate group of propanoyl-AMP; major species at pH 7.3

   

L-Phenylalanine, N-[[(3R)-5-chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl]carbonyl]-

L-Phenylalanine, N-[[(3R)-5-chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl]carbonyl]-

C20H17ClNO6- (402.0744)


   

1-hydroxy-2-[(2R,3R,4S,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]oxyanthracene-9,10-dione

1-hydroxy-2-[(2R,3R,4S,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]oxyanthracene-9,10-dione

C20H18O9 (402.0951)


   

CID 90659065

CID 90659065

C20H18O9 (402.0951)


   

(2R,3R,4S)-2-[(2S,3S,4S,5R)-5,6-dihydroxy-2-methyl-4-sulfooxyoxan-3-yl]oxy-3,4-dihydroxy-3,4-dihydro-2H-pyran-6-carboxylic acid

(2R,3R,4S)-2-[(2S,3S,4S,5R)-5,6-dihydroxy-2-methyl-4-sulfooxyoxan-3-yl]oxy-3,4-dihydroxy-3,4-dihydro-2H-pyran-6-carboxylic acid

C12H18O13S (402.0468)


   

variecolorquinone A

variecolorquinone A

C20H18O9 (402.0951)


An dihydroxyanthraquinone that is 1,6-dihydroxy-9,10-anthraquinone which is substituted by a methoxy group at position 8, a methyl group at position 3 and a [(2S)-2,3-dihydroxypropoxy]carbonyl group at position 2. Isolated from the fungus Aspergillus variecolor, it exhibits cytotoxic activity.

   

Cimicifugic acid K

Cimicifugic acid K

C20H18O9 (402.0951)


   

4-Chloro-3-(1-pyrrolidinylsulfonyl)benzoic acid [2-(butylamino)-2-oxoethyl] ester

4-Chloro-3-(1-pyrrolidinylsulfonyl)benzoic acid [2-(butylamino)-2-oxoethyl] ester

C17H23ClN2O5S (402.1016)


   

4-Fluorobenzoic acid 4-[[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester

4-Fluorobenzoic acid 4-[[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester

C19H12ClFN2O3S (402.0241)


   

4-{[5-(4-Chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}but-2-yn-1-yl 4-fluorobenzoate

4-{[5-(4-Chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}but-2-yn-1-yl 4-fluorobenzoate

C19H12ClFN2O3S (402.0241)


   

3-[[[2-(3-Methylphenyl)-4-quinolinyl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester

3-[[[2-(3-Methylphenyl)-4-quinolinyl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester

C23H18N2O3S (402.1038)


   

2-[2-nitro-4-(trifluoromethyl)phenoxy]-N-phenylbenzamide

2-[2-nitro-4-(trifluoromethyl)phenoxy]-N-phenylbenzamide

C20H13F3N2O4 (402.0827)


   

2-[[5-[(2-Chloroanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]thio]acetic acid ethyl ester

2-[[5-[(2-Chloroanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]thio]acetic acid ethyl ester

C19H19ClN4O2S (402.0917)


   

(1R,9aR)-octahydro-2H-quinolizin-1-ylmethyl (4-chlorophenoxy)sulfonylcarbamate

(1R,9aR)-octahydro-2H-quinolizin-1-ylmethyl (4-chlorophenoxy)sulfonylcarbamate

C17H23ClN2O5S (402.1016)


   

4-[[2-[(4-Methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]benzoic acid ethyl ester

4-[[2-[(4-Methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]benzoic acid ethyl ester

C18H18N4O3S2 (402.082)


   

1-[(2-chlorophenyl)methyl]-3-methyl-N-(4-methyl-2-thiazolyl)-5-thieno[2,3-c]pyrazolecarboxamide

1-[(2-chlorophenyl)methyl]-3-methyl-N-(4-methyl-2-thiazolyl)-5-thieno[2,3-c]pyrazolecarboxamide

C18H15ClN4OS2 (402.0376)


   

4-[(1-Methyl-5-tetrazolyl)thio]-5-(4-phenylphenyl)thieno[2,3-d]pyrimidine

4-[(1-Methyl-5-tetrazolyl)thio]-5-(4-phenylphenyl)thieno[2,3-d]pyrimidine

C20H14N6S2 (402.0721)


   

N-[3-(dimethylsulfamoyl)phenyl]-2-(4-quinazolinylthio)acetamide

N-[3-(dimethylsulfamoyl)phenyl]-2-(4-quinazolinylthio)acetamide

C18H18N4O3S2 (402.082)


   

(17S)-13,17-dihydroxy-12-(hydroxymethyl)-5-methoxy-7-methyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.03,8.014,18]octadeca-1(11),3(8),4,6,12,14(18)-hexaene-4-carbaldehyde

(17S)-13,17-dihydroxy-12-(hydroxymethyl)-5-methoxy-7-methyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.03,8.014,18]octadeca-1(11),3(8),4,6,12,14(18)-hexaene-4-carbaldehyde

C19H14O10 (402.0587)


   

2-Hydroxy-4-pentenylglucosinolate

2-Hydroxy-4-pentenylglucosinolate

C12H20NO10S2- (402.0529)


   

[4,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] hydrogen sulate

[4,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] hydrogen sulate

C15H14O11S (402.0257)


   

4,5-Dioxo-2-phenyl-1-(4-sulfamoylphenyl)-3-pyrrolidinecarboxylic acid ethyl ester

4,5-Dioxo-2-phenyl-1-(4-sulfamoylphenyl)-3-pyrrolidinecarboxylic acid ethyl ester

C19H18N2O6S (402.0886)


   

4-Acetyl-1-(5-bromopyridin-2-yl)-5-(4-methoxyphenyl)pyrrolidine-2,3-dione

4-Acetyl-1-(5-bromopyridin-2-yl)-5-(4-methoxyphenyl)pyrrolidine-2,3-dione

C18H15BrN2O4 (402.0215)


   

3,7-dihydroxy-2-(3-sulooxyphenyl)-3,4-dihydro-2H-chromene-5-sulinic acid

3,7-dihydroxy-2-(3-sulooxyphenyl)-3,4-dihydro-2H-chromene-5-sulinic acid

C15H14O9S2 (402.0079)


   

[3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl] hydrogen sulate

[3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl] hydrogen sulate

C15H14O11S (402.0257)


   

(1S,9S)-6,11,12-Trihydroxy-5,13-dimethoxy-1,9-dimethyl-16-oxo-8,17-dioxatetracyclo[7.7.1.02,7.010,15]heptadeca-2(7),3,5,10,12,14-hexaene-3-carbaldehyde

(1S,9S)-6,11,12-Trihydroxy-5,13-dimethoxy-1,9-dimethyl-16-oxo-8,17-dioxatetracyclo[7.7.1.02,7.010,15]heptadeca-2(7),3,5,10,12,14-hexaene-3-carbaldehyde

C20H18O9 (402.0951)


   

18-Bromo-4,10-diaza-15-azoniahexacyclo[14.3.1.15,9.01,6.07,15.08,12]henicosa-5,7(15),8(12),9(21),10,18-hexaene-17,20,21-triol

18-Bromo-4,10-diaza-15-azoniahexacyclo[14.3.1.15,9.01,6.07,15.08,12]henicosa-5,7(15),8(12),9(21),10,18-hexaene-17,20,21-triol

C18H17BrN3O3+ (402.0453)


   

Thymidine-5-diphosphate

Thymidine-5-diphosphate

C10H16N2O11P2 (402.0229)


A thymidine phosphate having a diphosphate group at the 5-position. D000890 - Anti-Infective Agents > D000998 - Antiviral Agents D000970 - Antineoplastic Agents

   

N-[(R)-4-phosphopantothenoyl]-L-cysteine

N-[(R)-4-phosphopantothenoyl]-L-cysteine

C12H23N2O9PS (402.0862)


The N-[(R)-4-phosphopantothenoyl] derivative of L-cysteine.

   

(3S)-versiconol acetate

(3S)-versiconol acetate

C20H18O9 (402.0951)


An optically active form of versiconol acetate having 3S-configuration.

   

ochratoxin A(1-)

ochratoxin A(1-)

C20H17ClNO6 (402.0744)


A monocarboxylic acid anion that is conjugate base of ochratoxin A, arising from the deprotonation of the carboxy group. Major microspecies at pH 7.3.

   

5-Hydroxy-3,3,7,8-tetramethoxy-4,5-methylenedioxyflavone

5-Hydroxy-3,3,7,8-tetramethoxy-4,5-methylenedioxyflavone

C20H18O9 (402.0951)


   

Mollicellin J

Mollicellin J

C21H19ClO6 (402.087)


A member of the class of depsidones that is 11H-dibenzo[b,e][1,4]dioxepine substituted by a chloro group at position 2, hydroxy groups at position 3 and 7, methyl group at positions 1 and 9, a prenyl group at position 8, an oxo group at position 11 and a formyl group at position 4. Isolated from Chaetomium brasiliense it exhibits cytotoxic activity.

   

N-(4-chlorophenoxy)sulfonylcarbamic acid [(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl ester

N-(4-chlorophenoxy)sulfonylcarbamic acid [(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl ester

C17H23ClN2O5S (402.1016)


   

gluconapoleiferin(1-)

gluconapoleiferin(1-)

C12H20NO10S2 (402.0529)


A glucosinolate that is glucobrassicanapin which has been hydroxylated at the 3-position of the hex-5-enimidoyl chain.

   
   
   

A-867744

A-867744

C20H19ClN2O3S (402.0805)


A-867744 is a highly potent and selective type II positive allosteric modulator (PAM) of the alpha7 nicotinic acetylcholine receptors (nAChR) with an EC50 of 1.0 μM[1].

   

AP521

AP521

C20H19ClN2O3S (402.0805)


AP521 is an agonist of human 5-HT1A receptor with an IC50 of 94 nM.

   

GKT136901 (hydrochloride)

GKT136901 (hydrochloride)

C19H16Cl2N4O2 (402.065)


GKT136901 hydrochloride is a potent, selective and orally active inhibitor of NADPH oxidase (NOX1/4), with Kis of 160 and 165 nM, respectively. GKT136901 hydrochloride is also a selective and direct scavenger of peroxynitrite. GKT136901 hydrochloride can be used for the research of diabetic nephropathy, stroke, and neurodegeneration. GKT136901 hydrochloride also has anti-inflammatory activity[1][2][3].

   

PEPA

PEPA

C16H16F2N2O4S2 (402.052)


PEPA is an allosteric modulator of AMPA receptors; binds to the GluA2o and GluA3o LBDs and can be utilized as an indicator of AMPA receptor heterogeneity. IC50 value: Target: AMPAR modulator in vitro: PEPA dose-dependently potentiated AMPA-induced increase of [Ca2+]i. In 90\% (72 out of 80) of the cells in which cyclothiazide acts, PEPA potentiated the increased [Ca2+]i induced by AMPA with pronounced cell-to-cell variation in rat hippocampal cultures [1]. PEPA bound to the binding domains of the GluA2 and GluA3 flop isoforms of AMPA receptors [2]. coapplication of AMPA with PEPA protected hippocampal CA1 neurons from brain ischemia-induced death. Coapplication of AMPA with PEPA could prevent downregulated expression of GluR2 subunit caused by ischemia and increase BDNF expression via Lyn-ERK1/2-CREB signaling [4]. in vivo: PEPA (3, 10, 30mg/kg body weight) or vehicle was intraperitoneally administered into stressed mice once before the first extinction session. The significant decrease of the freezing response in the extinction sessions was only seen in the 30mg/kg PEPA-administered stressed mice, compared with vehicle-administered stressed mice [3].

   

Pomaglumetad methionil (hydrochloride)

Pomaglumetad methionil (hydrochloride)

C12H19ClN2O7S2 (402.0322)


Pomaglumetad methionil hydrochloride (LY2140023 hydrochloride) is an orally active, methionine prodrug of the selective mGlu2/3 receptor agonist LY404039. Pomaglumetad methionil hydrochloride has the potential for schizophrenia research[1][2].

   

3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-1,8-dihydroxy-6-methylanthracene-9,10-dione

3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-1,8-dihydroxy-6-methylanthracene-9,10-dione

C20H18O9 (402.0951)


   

13,17-dihydroxy-12-(hydroxymethyl)-5-methoxy-7-methyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(11),3,5,7,12,14(18)-hexaene-4-carbaldehyde

13,17-dihydroxy-12-(hydroxymethyl)-5-methoxy-7-methyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(11),3,5,7,12,14(18)-hexaene-4-carbaldehyde

C19H14O10 (402.0587)


   

2-benzyl-3-{[3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-2-hydroxybutanedioic acid

2-benzyl-3-{[3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-2-hydroxybutanedioic acid

C20H18O9 (402.0951)


   

(2s,3s)-3-(3,4-dihydroxy-5-methoxyphenyl)-2-(hydroxymethyl)-5-methoxy-2h,3h-[1,4]dioxino[2,3-h]chromen-9-one

(2s,3s)-3-(3,4-dihydroxy-5-methoxyphenyl)-2-(hydroxymethyl)-5-methoxy-2h,3h-[1,4]dioxino[2,3-h]chromen-9-one

C20H18O9 (402.0951)


   

13-hydroxy-4-(hydroxymethyl)-5,17-dimethoxy-7,12-dimethyl-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(11),3,5,7,12,14(18)-hexaene-9,15-dione

13-hydroxy-4-(hydroxymethyl)-5,17-dimethoxy-7,12-dimethyl-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(11),3,5,7,12,14(18)-hexaene-9,15-dione

C20H18O9 (402.0951)


   

methyl 15,17-dihydroxy-7-methoxy-5,16-dimethyl-13-oxo-2,10,12-trioxatetracyclo[9.6.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(17),3(8),4,6,14(18),15-hexaene-4-carboxylate

methyl 15,17-dihydroxy-7-methoxy-5,16-dimethyl-13-oxo-2,10,12-trioxatetracyclo[9.6.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(17),3(8),4,6,14(18),15-hexaene-4-carboxylate

C20H18O9 (402.0951)


   

2-{[2-({2-amino-1-hydroxy-4-[methyl(oxo)(phosphonoimino)-λ⁶-sulfanyl]butylidene}amino)-1-hydroxypropylidene]amino}propanoic acid

2-{[2-({2-amino-1-hydroxy-4-[methyl(oxo)(phosphonoimino)-λ⁶-sulfanyl]butylidene}amino)-1-hydroxypropylidene]amino}propanoic acid

C11H23N4O8PS (402.0974)


   

(10'r,12'r,15'r)-1',6',9',10'-tetrahydroxy-12'-methyl-3h-13'-oxaspiro[pyran-2,16'-tetracyclo[7.6.1.0²,⁷.0¹⁰,¹⁵]hexadecane]-2',4',6'-triene-6,8',14'-trione

(10'r,12'r,15'r)-1',6',9',10'-tetrahydroxy-12'-methyl-3h-13'-oxaspiro[pyran-2,16'-tetracyclo[7.6.1.0²,⁷.0¹⁰,¹⁵]hexadecane]-2',4',6'-triene-6,8',14'-trione

C20H18O9 (402.0951)


   

methyl (11s)-15,17-dihydroxy-7-methoxy-5,16-dimethyl-13-oxo-2,10,12-trioxatetracyclo[9.6.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(17),3(8),4,6,14(18),15-hexaene-4-carboxylate

methyl (11s)-15,17-dihydroxy-7-methoxy-5,16-dimethyl-13-oxo-2,10,12-trioxatetracyclo[9.6.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(17),3(8),4,6,14(18),15-hexaene-4-carboxylate

C20H18O9 (402.0951)


   

(2r,3s)-2-hydroxy-2-[(4-hydroxyphenyl)methyl]-3-{[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}butanedioic acid

(2r,3s)-2-hydroxy-2-[(4-hydroxyphenyl)methyl]-3-{[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}butanedioic acid

C20H18O9 (402.0951)


   

3,4-methylenedioxy-3',4'-o-dimethyl-5,5'-di-methoxyellagicacid

NA

C19H14O10 (402.0587)


{"Ingredient_id": "HBIN007496","Ingredient_name": "3,4-methylenedioxy-3',4'-o-dimethyl-5,5'-di-methoxyellagicacid","Alias": "NA","Ingredient_formula": "C19H14O10","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14358","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

5-[2-carboxy-6,7-dihydroxy-3-(methoxycarbonyl)-1,2-dihydronaphthalen-1-yl]-6-oxopyran-2-carboxylic acid

5-[2-carboxy-6,7-dihydroxy-3-(methoxycarbonyl)-1,2-dihydronaphthalen-1-yl]-6-oxopyran-2-carboxylic acid

C19H14O10 (402.0587)


   

(1r)-4,9-dihydroxy-10-methoxy-1-phenyl-1h-anthra[1,2-c]furan-3,6,11-trione

(1r)-4,9-dihydroxy-10-methoxy-1-phenyl-1h-anthra[1,2-c]furan-3,6,11-trione

C23H14O7 (402.0739)


   

(2r,3s)-2-benzyl-3-{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-2-hydroxybutanedioic acid

(2r,3s)-2-benzyl-3-{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-2-hydroxybutanedioic acid

C20H18O9 (402.0951)


   

deoxythymidine 5'-diphosphate

deoxythymidine 5'-diphosphate

C10H16N2O11P2 (402.0229)


   

13,17-dihydroxy-5-methoxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(11),3,5,7,12,14(18)-hexaene-4-carboxylic acid

13,17-dihydroxy-5-methoxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(11),3,5,7,12,14(18)-hexaene-4-carboxylic acid

C19H14O10 (402.0587)


   

2,3-dihydroxypropyl 1,6-dihydroxy-8-methoxy-3-methyl-9,10-dioxoanthracene-2-carboxylate

2,3-dihydroxypropyl 1,6-dihydroxy-8-methoxy-3-methyl-9,10-dioxoanthracene-2-carboxylate

C20H18O9 (402.0951)


   

(2r,3s)-2-hydroxy-2-[(4-hydroxyphenyl)methyl]-3-{[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}butanedioic acid

(2r,3s)-2-hydroxy-2-[(4-hydroxyphenyl)methyl]-3-{[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}butanedioic acid

C20H18O9 (402.0951)


   

(2r)-2-[(3-{[(2r)-1,2-dihydroxy-3,3-dimethyl-4-(phosphonooxy)butylidene]amino}-1-hydroxypropylidene)amino]-3-sulfanylpropanoic acid

(2r)-2-[(3-{[(2r)-1,2-dihydroxy-3,3-dimethyl-4-(phosphonooxy)butylidene]amino}-1-hydroxypropylidene)amino]-3-sulfanylpropanoic acid

C12H23N2O9PS (402.0862)


   

(2r,3r,4s,6r,11'r,15'r)-3,4,4'-trihydroxy-6-methyl-12',16'-dioxaspiro[oxane-2,17'-tetracyclo[8.7.0.0³,⁸.0¹¹,¹⁵]heptadecane]-1'(10'),3',5',7'-tetraene-2',9',13'-trione

(2r,3r,4s,6r,11'r,15'r)-3,4,4'-trihydroxy-6-methyl-12',16'-dioxaspiro[oxane-2,17'-tetracyclo[8.7.0.0³,⁸.0¹¹,¹⁵]heptadecane]-1'(10'),3',5',7'-tetraene-2',9',13'-trione

C20H18O9 (402.0951)


   

2-(2h-1,3-benzodioxol-5-yl)-7-hydroxy-3,5,6,8-tetramethoxychromen-4-one

2-(2h-1,3-benzodioxol-5-yl)-7-hydroxy-3,5,6,8-tetramethoxychromen-4-one

C20H18O9 (402.0951)


   

(2s,3s,4s,6s,11's,15's)-3,4,4'-trihydroxy-6-methyl-12',16'-dioxaspiro[oxane-2,17'-tetracyclo[8.7.0.0³,⁸.0¹¹,¹⁵]heptadecane]-1'(10'),3',5',7'-tetraene-2',9',13'-trione

(2s,3s,4s,6s,11's,15's)-3,4,4'-trihydroxy-6-methyl-12',16'-dioxaspiro[oxane-2,17'-tetracyclo[8.7.0.0³,⁸.0¹¹,¹⁵]heptadecane]-1'(10'),3',5',7'-tetraene-2',9',13'-trione

C20H18O9 (402.0951)


   

2-hydroxy-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}anthracene-9,10-dione

2-hydroxy-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}anthracene-9,10-dione

C20H18O9 (402.0951)


   

5,7-dihydroxy-2-(4-hydroxyphenyl)-6-[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]chromen-4-one

5,7-dihydroxy-2-(4-hydroxyphenyl)-6-[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]chromen-4-one

C20H18O9 (402.0951)


   

2-chloro-7-[(1e)-hex-1-en-1-yl]-1,6,8-trihydroxy-3-methoxyanthracene-9,10-dione

2-chloro-7-[(1e)-hex-1-en-1-yl]-1,6,8-trihydroxy-3-methoxyanthracene-9,10-dione

C21H19ClO6 (402.087)


   

5-[(1r,2r)-2-carboxy-6,7-dihydroxy-3-(methoxycarbonyl)-1,2-dihydronaphthalen-1-yl]-6-oxopyran-2-carboxylic acid

5-[(1r,2r)-2-carboxy-6,7-dihydroxy-3-(methoxycarbonyl)-1,2-dihydronaphthalen-1-yl]-6-oxopyran-2-carboxylic acid

C19H14O10 (402.0587)


   

(17s)-13-hydroxy-4-(hydroxymethyl)-5,17-dimethoxy-7,12-dimethyl-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(11),3,5,7,12,14(18)-hexaene-9,15-dione

(17s)-13-hydroxy-4-(hydroxymethyl)-5,17-dimethoxy-7,12-dimethyl-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(11),3,5,7,12,14(18)-hexaene-9,15-dione

C20H18O9 (402.0951)


   

(17s)-13,17-dihydroxy-12-(hydroxymethyl)-5-methoxy-7-methyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(11),3,5,7,12,14(18)-hexaene-4-carbaldehyde

(17s)-13,17-dihydroxy-12-(hydroxymethyl)-5-methoxy-7-methyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(11),3,5,7,12,14(18)-hexaene-4-carbaldehyde

C19H14O10 (402.0587)


   

7-hydroxy-5,6,8-trimethoxy-2-(7-methoxy-2h-1,3-benzodioxol-5-yl)chromen-4-one

7-hydroxy-5,6,8-trimethoxy-2-(7-methoxy-2h-1,3-benzodioxol-5-yl)chromen-4-one

C20H18O9 (402.0951)


   

5,7-dihydroxy-2-(4-hydroxyphenyl)-6-(3,4,5-trihydroxyoxan-2-yl)chromen-4-one

5,7-dihydroxy-2-(4-hydroxyphenyl)-6-(3,4,5-trihydroxyoxan-2-yl)chromen-4-one

C20H18O9 (402.0951)


   

7,12,13,14-tetramethoxy-3,5,10,17-tetraoxapentacyclo[9.6.2.0²,⁶.0⁸,¹⁸.0¹⁵,¹⁹]nonadeca-1,6,8(18),11(19),12,14-hexaene-9,16-dione

7,12,13,14-tetramethoxy-3,5,10,17-tetraoxapentacyclo[9.6.2.0²,⁶.0⁸,¹⁸.0¹⁵,¹⁹]nonadeca-1,6,8(18),11(19),12,14-hexaene-9,16-dione

C19H14O10 (402.0587)


   

5-[3-carboxy-6,7-dihydroxy-2-(methoxycarbonyl)-1,2-dihydronaphthalen-1-yl]-6-oxopyran-2-carboxylic acid

5-[3-carboxy-6,7-dihydroxy-2-(methoxycarbonyl)-1,2-dihydronaphthalen-1-yl]-6-oxopyran-2-carboxylic acid

C19H14O10 (402.0587)


   

3,4,4'-trihydroxy-6-methyl-12',16'-dioxaspiro[oxane-2,17'-tetracyclo[8.7.0.0³,⁸.0¹¹,¹⁵]heptadecane]-1'(10'),3',5',7'-tetraene-2',9',13'-trione

3,4,4'-trihydroxy-6-methyl-12',16'-dioxaspiro[oxane-2,17'-tetracyclo[8.7.0.0³,⁸.0¹¹,¹⁵]heptadecane]-1'(10'),3',5',7'-tetraene-2',9',13'-trione

C20H18O9 (402.0951)


   

4-hydroxy-2-(5-hydroxy-3,7,8-trimethoxy-4-oxochromen-2-yl)phenyl acetate

4-hydroxy-2-(5-hydroxy-3,7,8-trimethoxy-4-oxochromen-2-yl)phenyl acetate

C20H18O9 (402.0951)


   

5,7-dihydroxy-2-(4-hydroxyphenyl)-6-[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]chromen-4-one

5,7-dihydroxy-2-(4-hydroxyphenyl)-6-[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]chromen-4-one

C20H18O9 (402.0951)


   

(17s)-13,17-dihydroxy-5-methoxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(11),3,5,7,12,14(18)-hexaene-4-carboxylic acid

(17s)-13,17-dihydroxy-5-methoxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(11),3,5,7,12,14(18)-hexaene-4-carboxylic acid

C19H14O10 (402.0587)


   

5-[(1s,3as,4r,6ar)-4-(2h-1,3-benzodioxol-5-yloxy)-3a-hydroxy-tetrahydro-1h-furo[3,4-c]furan-1-yl]-2h-1,3-benzodioxol-4-ol

5-[(1s,3as,4r,6ar)-4-(2h-1,3-benzodioxol-5-yloxy)-3a-hydroxy-tetrahydro-1h-furo[3,4-c]furan-1-yl]-2h-1,3-benzodioxol-4-ol

C20H18O9 (402.0951)


   

2-chloro-7-(hex-1-en-1-yl)-1,6,8-trihydroxy-3-methoxyanthracene-9,10-dione

2-chloro-7-(hex-1-en-1-yl)-1,6,8-trihydroxy-3-methoxyanthracene-9,10-dione

C21H19ClO6 (402.087)


   

2-hydroxy-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}anthracene-9,10-dione

2-hydroxy-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}anthracene-9,10-dione

C20H18O9 (402.0951)


   

(2r)-2,3-dihydroxypropyl 1,6-dihydroxy-8-methoxy-3-methyl-9,10-dioxoanthracene-2-carboxylate

(2r)-2,3-dihydroxypropyl 1,6-dihydroxy-8-methoxy-3-methyl-9,10-dioxoanthracene-2-carboxylate

C20H18O9 (402.0951)


   

5-[(1r,2r)-3-carboxy-6,7-dihydroxy-2-(methoxycarbonyl)-1,2-dihydronaphthalen-1-yl]-6-oxopyran-2-carboxylic acid

5-[(1r,2r)-3-carboxy-6,7-dihydroxy-2-(methoxycarbonyl)-1,2-dihydronaphthalen-1-yl]-6-oxopyran-2-carboxylic acid

C19H14O10 (402.0587)


   

(2s,3s)-2-(3,4-dihydroxy-5-methoxyphenyl)-3-(hydroxymethyl)-5-methoxy-2h,3h-[1,4]dioxino[2,3-h]chromen-9-one

(2s,3s)-2-(3,4-dihydroxy-5-methoxyphenyl)-3-(hydroxymethyl)-5-methoxy-2h,3h-[1,4]dioxino[2,3-h]chromen-9-one

C20H18O9 (402.0951)


   

6-[(2s,3s,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one

6-[(2s,3s,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one

C20H18O9 (402.0951)


   

5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]chromen-4-one

5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]chromen-4-one

C20H18O9 (402.0951)


   

(1r,4s,5s,6s)-5-[(benzoyloxy)methyl]-4-chloro-5,6-dihydroxycyclohex-2-en-1-yl benzoate

(1r,4s,5s,6s)-5-[(benzoyloxy)methyl]-4-chloro-5,6-dihydroxycyclohex-2-en-1-yl benzoate

C21H19ClO6 (402.087)