Exact Mass: 400.092

Exact Mass Matches: 400.092

Found 447 metabolites which its exact mass value is equals to given mass value 400.092, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

4'-Demethylepipodophyllotoxin

(5S,5aR,8aR,9R)-5-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one

C21H20O8 (400.1158)


4-demethylepipodophyllotoxin is an organic heterotetracyclic compound that is the 9- epimer of 4-demethylpodophyllotoxin. It has a role as an antineoplastic agent. It is a furonaphthodioxole, an organic heterotetracyclic compound and a member of phenols. An organic heterotetracyclic compound that is the 9- epimer of 4-demethylpodophyllotoxin. 4'-Demethylepipodophyllotoxin (4'-DMEP) is an intermediate compound that inhibits microtubule assembly. 4'-Demethylepipodophyllotoxin (4'-DMEP) is an intermediate compound that inhibits microtubule assembly.

   

alpha-Peltatin

alpha-Peltatin

C21H20O8 (400.1158)


An organic heterotetracyclic compound that is 4-demethylpodophyllotoxin which is substituted by a hydroxy group at position 10 but which is lacking the hydroxy group at position 9. It is found as a glucoside in the rhizomes of Podophyllum peltatum. relative retention time with respect to 9-anthracene Carboxylic Acid is 0.898 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.899 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.887 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.886

   

Flavonol 3-O-D-galactoside

2-phenyl-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-4-one

C21H20O8 (400.1158)


   

S-Acetylphosphopantetheine

S-Acetylphosphopantetheine

C13H25N2O8PS (400.1069)


   

bis(glycerophospho)glycerol

Bis(glycerophospho)-glycerol

C9H22O13P2 (400.0536)


   

Oprea1_595302

Isoflavone 7-O-beta-D-glucoside

C21H20O8 (400.1158)


   

4-Demethylpodophyllotoxin

4-O-demethylepipodophyllotoxin;4-DMEP

C21H20O8 (400.1158)


4'-Demethylpodophyllotoxin is an aryltetralin lignin contained in the root of Podophyllum hexandrum and P. peltatum. 4'-Demethylpodophyllotoxin exhibits cytotoxic potential in diverse cancer cell lines[1][2]. 4'-Demethylpodophyllotoxin is an aryltetralin lignin contained in the root of Podophyllum hexandrum and P. peltatum. 4'-Demethylpodophyllotoxin exhibits cytotoxic potential in diverse cancer cell lines[1][2].

   

4-Demethylpremithramycinone

4-Demethylpremithramycinone

C20H16O9 (400.0794)


   

4-(5,6,7,8-Tetramethoxy-4-oxo-4H-chromen-2-yl)phenyl acetate

2-[4-(Acetyloxy)phenyl]-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one

C21H20O8 (400.1158)


   

Versiconal hemiacetal acetate

(2S,3S)-versiconal hemiacetal acetate

C20H16O9 (400.0794)


An anthrafuran that is 2,3-dihydroanthra[2,3-b]furan-5,10-dione substituted at positions 2, 4, 6 and 8 by hydroxy groups and at position 3 by a 2-acetoxyethyl group. An intermediate in the biosynthesis of aflatoxin.

   

Flavonol 3-O-D-glucoside

Flavonol 3-O-beta-D-glucoside

C21H20O8 (400.1158)


   

Theobromine, calcium salt

Theobromine, calcium salt

C14H16CaN8O4 (400.092)


   

Flavonol 3-O-D-glycoside

Flavonol 3-O-beta-D-glycoside

C21H20O8 (400.1158)


   

Zuclopenthixol

2-(4-{3-[(9Z)-2-chloro-9H-thioxanthen-9-ylidene]propyl}piperazin-1-yl)ethan-1-ol

C22H25ClN2OS (400.1376)


Zuclopenthixol is only found in individuals that have used or taken this drug. It is a thioxanthene with therapeutic actions similar to the phenothiazine antipsychotics. It is an antagonist at D1 and D2 dopamine receptors. [PubChem]Zuclopenthixol is a typical antipsychotic neuroleptic drug of the thioxanthene group. It mainly acts by antagonism of D1 and D2 dopamine receptors. Zuclopenthixol also has high affinity for alpha1-adrenergic and 5-HT2 receptors. It has weaker histamine H1 receptor blocking activity, and even lower affinity for muscarinic cholinergic and alpha2-adrenergic receptors. D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents N - Nervous system > N05 - Psycholeptics > N05A - Antipsychotics > N05AF - Thioxanthene derivatives D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents > D018492 - Dopamine Antagonists D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent Zuclopenthixol ((Z)-Clopenthixol) is a thioxanthene derivative which acts as a mixed dopamine D1/D2 receptor antagonist[1][2].

   

Theaflagallin

2,3,4,5-tetrahydroxy-8-(3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)-6H-benzo[7]annulen-6-one

C20H16O9 (400.0794)


Red pigment from black tea (Camellia sinensis variety assamica). Theaflagallin is found in tea. Epitheaflagallin is found in tea. Epitheaflagallin is a pigment from black tea.

   

5-Hydroxyflavone

2-phenyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-one

C21H20O8 (400.1158)


5-Hydroxyflavone is found in pulses. 5-Hydroxyflavone is a constituent of Medicago sativa. Constituent of Medicago sativa. 5-Hydroxyflavone is found in pulses.

   

5-(3',4',5'-Trihydroxyphenyl)-gamma-valerolactone-3'-O-glucuronide

(2S,3S,4S,5R)-6-{2,3-dihydroxy-5-[(5-oxooxolan-2-yl)methyl]phenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

C17H20O11 (400.1006)


5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone-3-O-glucuronide is a conjugate of 5-(3,4,5-trihydroxyphenyl)-gamma-valerolactone and glucuronide. A glucuronide, also known as glucuronoside, is any substance produced by linking glucuronic acid to another substance via a glycosidic bond. The glucuronides belong to the glycosides. (Wikipedia)

   

5-(3',4',5'-Trihydroxyphenyl)-gamma-valerolactone-4'-O-glucuronide

(2S,3S,4S,5R,6S)-6-{2,6-dihydroxy-4-[(5-oxooxolan-2-yl)methyl]phenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

C17H20O11 (400.1006)


5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone-4-O-glucuronide is a conjugate of 5-(3,4,5-trihydroxyphenyl)-gamma-valerolactone and glucuronide. A glucuronide, also known as glucuronoside, is any substance produced by linking glucuronic acid to another substance via a glycosidic bond. The glucuronides belong to the glycosides. (Wikipedia)

   

Sinapinic acid-O-glucuronide isomer

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-{[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxy}oxane-2-carboxylic acid

C17H20O11 (400.1006)


Sinapinic acid-O-glucuronide isomer is a conjugate of Sinapinic acid and glucuronide. A glucuronide, also known as glucuronoside, is any substance produced by linking glucuronic acid to another substance via a glycosidic bond. The glucuronides belong to the glycosides. (Wikipedia)

   

Sinapic acid 4-O-glucuronide

(2S,3S,4S,5R,6S)-6-{4-[(1E)-2-carboxyeth-1-en-1-yl]-2,6-dimethoxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

C17H20O11 (400.1006)


Sinapic acid 4-O-glucuronide is an endogenous phenolic acid metabolite. Sinapic acid 4-O-glucuronide was found to be elevated in rat urine after whole rye consumption which makes this compound a potential urinary biomarker of whole grain intake (PMID: 26862900).

   

Sinapic acid glucuronide

(2S,3S,4S,5R,6S)-6-[4-(2-carboxyeth-1-en-1-yl)-2,6-dimethoxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

C17H20O11 (400.1006)


   

Aglycone C

8-(1,2-dihydroxyethyl)-6,8,11-trihydroxy-1-methoxy-5,7,8,9,10,12-hexahydrotetracene-5,12-dione

C21H20O8 (400.1158)


   

4'-Demethylepipodophyllotoxin

(5S,5aR,8aR,9R)-5-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one

C21H20O8 (400.1158)


   

Cbmida

2-{[(4-{[bis(carboxymethyl)amino]methyl}-2,3-dihydroxyphenyl)methyl](carboxymethyl)amino}acetic acid

C16H20N2O10 (400.1118)


   

Chlorpenthixol

2-{4-[3-(2-chloro-10H-dibenzo[b,e]thiopyran-10-ylidene)propyl]piperazin-1-yl}ethanol

C22H25ClN2OS (400.1376)


   

Flavonol 3-O-D-glucoside

2-phenyl-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-one

C21H20O8 (400.1158)


   

1H-Pyrrole-2,5-dione, 3-(1-methyl-1h-indol-3-yl)-4-(1-methyl-6-nitro-1h-indol-3-yl)-

3-(1-methyl-1H-indol-3-yl)-4-(1-methyl-6-nitro-1H-indol-3-yl)-2,5-dihydro-1H-pyrrole-2,5-dione

C22H16N4O4 (400.1171)


C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C273 - Antimitotic Agent MKC-1 (Ro-31-7453) is an orally active and potent cell cycle inhibitor with broad antitumor activity. MKC-1 inhibits the Akt/mTOR pathway. MKC-1 arrests cellular mitosis and induces cell apoptosis by binding to a number of different cellular proteins including tubulin and members of the importin β family[1][2][3].

   

Nicousamide Pyrotinib Maleate

[2-carboxy-4-(8-methyl-6-nitro-7-oxido-2-oxo-2H-chromene-3-amido)phenyl]oxidanium

C18H12N2O9 (400.0543)


   

TRICIRIBINE PHOSPHATE

[(5-{5-amino-7-methyl-2,6,7,9,11-pentaazatricyclo[6.3.1.0^{4,12}]dodeca-1(12),3,5,8,10-pentaen-2-yl}-3,4-dihydroxyoxolan-2-yl)methoxy]phosphonic acid

C13H17N6O7P (400.0896)


   

7N5E50463V

Furo(3,4:6,7)naphtho(2,3-d)-1,3-dioxol-6(5ah)-one, 5,8,8a,9-tetrahydro-9-hydroxy-5-(4-hydroxy-3,5-dimethoxyphenyl)-, (5R-(5-alpha,5a-beta,8a-alpha,9-alpha))-

C21H20O8 (400.1158)


4-demethylpodophyllotoxin is an organic heterotetracyclic compound that is podophyllotoxin in which the methyl ether group at position 4 of the trimethoxyphenyl group has been cleaved to afford the corresponding phenol. It has a role as a metabolite. It is a furonaphthodioxole, an organic heterotetracyclic compound and a member of phenols. 4-Demethylpodophyllotoxin is a natural product found in Diphylleia grayi, Podophyllum peltatum, and other organisms with data available. An organic heterotetracyclic compound that is podophyllotoxin in which the methyl ether group at position 4 of the trimethoxyphenyl group has been cleaved to afford the corresponding phenol. 4'-Demethylpodophyllotoxin is an aryltetralin lignin contained in the root of Podophyllum hexandrum and P. peltatum. 4'-Demethylpodophyllotoxin exhibits cytotoxic potential in diverse cancer cell lines[1][2]. 4'-Demethylpodophyllotoxin is an aryltetralin lignin contained in the root of Podophyllum hexandrum and P. peltatum. 4'-Demethylpodophyllotoxin exhibits cytotoxic potential in diverse cancer cell lines[1][2].

   

Stemonacetal

6-Ethoxy-11-hydroxy-2,3,9-trimethoxy [ 1 ] benzopyrano [ 3,4-b ] [ 1 ] benzopyran-12 (6H) -one

C21H20O8 (400.1158)


   

Synargentolide E

Synargentolide E

C18H24O10 (400.1369)


   

Paeciloquinone B

(+-)-9,10-Dihydro-1,3,6,8-tetrahydroxy-9,10-dioxo-a-(3-oxobutyl)-2-anthraceneacetic acid

C20H16O9 (400.0794)


   
   

Torosaflavone A

6- (2,6-Dideoxy-beta-D-lyxo-hexopyranosyl) -5,7-dihydroxy-2- (4-hydroxyphenyl) -4H-1-benzopyran-4-one

C21H20O8 (400.1158)


   

Lisetin hydrate

5,7,4-Trihydroxy-5-methoxy-3-(2,3-hydroxyprenyl)coumaronochromone

C21H20O8 (400.1158)


   

(-)-Altissinone

(-)-Altissinone

C21H20O8 (400.1158)


   

Mirificoumestan glycol

3,9-Dihydroxy-8-methoxy-7- (2,3-dihydroxy-3-methylbutyl) coumestan

C21H20O8 (400.1158)


   

Lespedezacoumestan

Lespedezacoumestan

C21H20O8 (400.1158)


   

Kynapcin-28

Kynapcin-28

C19H12O10 (400.043)


   

Xestoquinol sulfate

Xestoquinol sulfate

C20H16O7S (400.0617)


   

3-O-beta-Glucopyranosyl plumbagic acid methyl ester

3-O-beta-Glucopyranosyl plumbagic acid methyl ester

C18H24O10 (400.1369)


   

Piscidanol

5,7,4,5-Tetrahydroxy-5-methoxy-6,6-dimethyl-4,5-dihydropyrano[2,3:3,2]isoflavone

C21H20O8 (400.1158)


   

Linderofruticoside A

Linderofruticoside A

C17H20O11 (400.1006)


   

Piscerisoflavone D

5,7,2,5-Tetrahydroxy-5-methoxy-6,6-dimethyl-4,5-dihydropyrano[2,3:4,3]isoflavone

C21H20O8 (400.1158)


   

Piscerisoflavone A

Piscerisoflavone A

C21H20O8 (400.1158)


   

Piscerisoflavone B

5,7,2-Trihydroxy-5-methoxy-5-(1-hydroxy-1-methylethyl)-4,5-dihydrofurano[2,3,4,3]isoflavone

C21H20O8 (400.1158)


   

Synargentolide C

Synargentolide C

C18H24O10 (400.1369)


   
   

Sophoronol B

Sophoronol B

C21H20O8 (400.1158)


   
   

Piscerythrol

(2S,3S)-3,5,7,4-Tetrahydroxy-5-methoxy-3-prenylcoumaranochroman-4-one

C21H20O8 (400.1158)


   

Piscerisoflavone C

5,7,4,5-Tetrahydroxy-5-methoxy-6,6-dimethyl-4,5-dihydropyrano[2,3:2,3]isoflavone

C21H20O8 (400.1158)


   

Dracunculifoside E

Dracunculifoside E

C18H24O10 (400.1369)


   

(-)-8-(2-Carboxy-1-phenylethyl)-3,5,7-trihydroxyflavone delta-lactone

(-)-9,10-Dihydro-3,5-dihydroxy-2,10-diphenyl-4H,8H-benzo[1,2-b:3,4-b]dipyran-4,8-dione

C24H16O6 (400.0947)


   

trans-Hydroxypiscerythrone

trans-Hydroxypiscerythrone

C21H20O8 (400.1158)


   

6-Hydroxy-4-methoxyflavone 6-O-alpha-L-arabinopyranoside

6-Hydroxy-4-methoxyflavone 6-O-alpha-L-arabinopyranoside

C21H20O8 (400.1158)


   

3,5,7,4-Tetrahydroxy-8-C-(3-methylsuccinoyl)flavone

3,5,7-Trihydroxy-2- (4-hydroxyphenyl) -alpha-methyl-gamma,4-dioxo-4H-1-benzopyran-8-butanoic acid

C20H16O9 (400.0794)


   

3,5,7,4-Tetrahydroxy-8-methoxyflavanone 3-angelate

3,5,7,4-Tetrahydroxy-8-methoxyflavanone 3-angelate

C21H20O8 (400.1158)


   

Thymusin 6-isobutyrate

5-Hydroxy-2- (4-hydroxyphenyl) -7,8-dimethoxy-4-oxo-4H-1-benzopyran-6-yl ester 2-methyl-propanoic acid

C21H20O8 (400.1158)


   

Cylindroxanthone B

Cylindroxanthone B

C21H20O8 (400.1158)


   

3,5,8-Trimethoxy-6,7:3,4-bis(methylenedioxy)flavone

6- (1,3-Benzodioxol-5-yl) -4,7,9-trimethoxy-8H-1,3-dioxolo [ 4,5-g ] [ 1 ] benzopyran-8-one

C20H16O9 (400.0794)


   

Lophirone J

(S)-2,3-Dihydro-7-methoxy-2-[2-(4-methoxyphenyl)-5-benzofuranyl]-4H-1-benzopyran-4-one

C25H20O5 (400.1311)


   

1-O-Caffeoyl-3-O-p-coumaroylglycerol

1-O-Caffeoyl-3-O-p-coumaroylglycerol

C21H20O8 (400.1158)


   

Herbacetin 7,4-dimethyl ether 8-butyrate

Herbacetin 7,4-dimethyl ether 8-butyrate

C21H20O8 (400.1158)


   

3,5,3-Trimethoxy-6,7:4,5-bis(methylenedioxy)flavone

3,5,3-Trimethoxy-6,7:4,5-bis(methylenedioxy)flavone

C20H16O9 (400.0794)


   

Lophirone D

Lophirone D

C24H16O6 (400.0947)


   

URB447

[4-amino-1-[(4-chlorophenyl)methyl]-2-methyl-5-phenyl-1H-pyrrol-3-yl]phenyl-methanone

C25H21ClN2O (400.1342)


   

[3,4,5-triacetyloxy-6-(2H-tetrazol-5-yl)oxan-2-yl]methyl Acetate

[3,4,5-triacetyloxy-6-(2H-tetrazol-5-yl)oxan-2-yl]methyl Acetate

C15H20N4O9 (400.123)


   
   

ACon0_000976

ACon0_000976

C21H20O8 (400.1158)


   
   

5-hydroxy-6,8-dimethoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one

5-hydroxy-6,8-dimethoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one

C17H20O11 (400.1006)


   
   

Sphagnorubin B

Sphagnorubin B

C24H16O6 (400.0947)


   

Indicolactonedial

Indicolactonedial

C21H20O8 (400.1158)


   

epi-regaloside A

epi-regaloside A

C18H24O10 (400.1369)


   

2-[(2,3-di-O-acetyl-beta-D-glucopyranosyl)oxy]-6-hydroxybenzoic acid

2-[(2,3-di-O-acetyl-beta-D-glucopyranosyl)oxy]-6-hydroxybenzoic acid

C17H20O11 (400.1006)


   

2,2-diamino-7,8,5,6,7,8-hexahydro-3H,3H-6,6-(3-hydroxy-2-oxo-propan-1-yl-1-ylidene)-bis-pteridin-4-one|Neodrosopterin

2,2-diamino-7,8,5,6,7,8-hexahydro-3H,3H-6,6-(3-hydroxy-2-oxo-propan-1-yl-1-ylidene)-bis-pteridin-4-one|Neodrosopterin

C15H16N10O4 (400.1356)


   
   

4beta-(chloromethyl)-3beta,4alpha-dihydroxy,8alpha-[(S)-3-hydroxy-2-methylpropionyloxy]-1alphaH,5alphaH,6betaH,7alphaH-guaia-10(14),11(13)-dien-6,12-olide

4beta-(chloromethyl)-3beta,4alpha-dihydroxy,8alpha-[(S)-3-hydroxy-2-methylpropionyloxy]-1alphaH,5alphaH,6betaH,7alphaH-guaia-10(14),11(13)-dien-6,12-olide

C19H25ClO7 (400.1289)


   

Methylstictic acid

Methylstictic acid

C20H16O9 (400.0794)


   

7,10-Di-Me ether-3,7,9,10-Tetrahyedroxypterocarpan

7,10-Di-Me ether-3,7,9,10-Tetrahyedroxypterocarpan

C21H20O8 (400.1158)


   

3-epi-welwitindolinone B isothiocyanate

3-epi-welwitindolinone B isothiocyanate

C21H21ClN2O2S (400.1012)


   

1,2,8-triacetoxy-6-methoxy-xanthen-9-one|1,7,8-Triacetoxy-3-methoxyxanthon|gentiakochianin acetate

1,2,8-triacetoxy-6-methoxy-xanthen-9-one|1,7,8-Triacetoxy-3-methoxyxanthon|gentiakochianin acetate

C20H16O9 (400.0794)


   

2-hydroxy-alpha,4,4-triacetoxydihydrochalcone

2-hydroxy-alpha,4,4-triacetoxydihydrochalcone

C21H20O8 (400.1158)


   

cercophorin A

cercophorin A

C20H16O9 (400.0794)


   

chrysin-6-C-fucopyranoside

chrysin-6-C-fucopyranoside

C21H20O8 (400.1158)


   

makilalactone E

makilalactone E

C18H21ClO8 (400.0925)


   

Man-(1-->4)-3-deoxy-D-manno-2-octulosonic acid

Man-(1-->4)-3-deoxy-D-manno-2-octulosonic acid

C14H24O13 (400.1217)


   

Calomelanol F

Calomelanol F

C24H16O6 (400.0947)


   

uvarirufone A|{(1S,2S,3R,4R)-1,2,4-trihydroxy-6-oxo-3-[(benzoyl)oxy]cyclohexyl}methyl benzoate

uvarirufone A|{(1S,2S,3R,4R)-1,2,4-trihydroxy-6-oxo-3-[(benzoyl)oxy]cyclohexyl}methyl benzoate

C21H20O8 (400.1158)


   

4-dehydro-deacetylgriseusin A

4-dehydro-deacetylgriseusin A

C20H16O9 (400.0794)


   

Hormothamnione

Hormothamnione

C21H20O8 (400.1158)


   

3-deoxy-7-O-alpha-D-galactopyranosyl-D-manno-2-octulopyranosonate

3-deoxy-7-O-alpha-D-galactopyranosyl-D-manno-2-octulopyranosonate

C14H24O13 (400.1217)


   

Regaloside D

[(2R)-3-Hydroxy-2-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl] (E)-3-(4-hydroxyphenyl)prop-2-enoate

C18H24O10 (400.1369)


   

cleomiscosin A methyl ether

cleomiscosin A methyl ether

C21H20O8 (400.1158)


   

Dehydrokuanoniamine B

Dehydrokuanoniamine B

C23H20N4OS (400.1358)


   

Methylarboreol

Methylarboreol

C21H20O8 (400.1158)


   
   
   

5-acetoxy-3,3,4,5-tetramethoxyflavone|5-Acetoxy-3-methoxy-2-(3,4,5-trimethoxy-phenyl)-chromen-4-on|5-acetoxy-3-methoxy-2-(3,4,5-trimethoxy-phenyl)-chromen-4-one

5-acetoxy-3,3,4,5-tetramethoxyflavone|5-Acetoxy-3-methoxy-2-(3,4,5-trimethoxy-phenyl)-chromen-4-on|5-acetoxy-3-methoxy-2-(3,4,5-trimethoxy-phenyl)-chromen-4-one

C21H20O8 (400.1158)


   

canthin-6-one 9-O-beta-glucopyranoside

canthin-6-one 9-O-beta-glucopyranoside

C20H20N2O7 (400.127)


   

DTXSID30966362

DTXSID30966362

C20H16O9 (400.0794)


   

(-)-(1S*,2S*,3R*,4R*,5R*,6R*)-3-O-benzoyl-1-benzoyloxymethyl-1,6-epoxycyclohexane-2,3,4,5-tetrol|(-)-rotepoxide A

(-)-(1S*,2S*,3R*,4R*,5R*,6R*)-3-O-benzoyl-1-benzoyloxymethyl-1,6-epoxycyclohexane-2,3,4,5-tetrol|(-)-rotepoxide A

C21H20O8 (400.1158)


   

(-)-(1S*,2S*,3S*,4S*,5R*,6R*)-4-O-benzoyl-1-benzoyloxymethyl-1,6-epoxycyclohexane-2,3,4,5-tetrol|(-)-rotepoxide B

(-)-(1S*,2S*,3S*,4S*,5R*,6R*)-4-O-benzoyl-1-benzoyloxymethyl-1,6-epoxycyclohexane-2,3,4,5-tetrol|(-)-rotepoxide B

C21H20O8 (400.1158)


   

2,3-dihydroxyanisolactone

2,3-dihydroxyanisolactone

C21H20O8 (400.1158)


   

4-O-beta-D-glucopyranosylsinapic acid methyl ester

4-O-beta-D-glucopyranosylsinapic acid methyl ester

C18H24O10 (400.1369)


   
   

(3S,4S)-4-[(7-hydroxy-1,3-benzodioxol-5-yl)(7-methoxy-1,3-benzodioxol-5-yl)-methyl]-3-methyldihydrofuran-2(3H)-one|peperomin H

(3S,4S)-4-[(7-hydroxy-1,3-benzodioxol-5-yl)(7-methoxy-1,3-benzodioxol-5-yl)-methyl]-3-methyldihydrofuran-2(3H)-one|peperomin H

C21H20O8 (400.1158)


   

3,8,9,10,11-Pentamethoxy-5,7-dihydro[2]benzopyrano[4,3-b][1]benzopyran-7-one

3,8,9,10,11-Pentamethoxy-5,7-dihydro[2]benzopyrano[4,3-b][1]benzopyran-7-one

C21H20O8 (400.1158)


   

8-C-beta-D-boivinopyranosylapigenin

8-C-beta-D-boivinopyranosylapigenin

C21H20O8 (400.1158)


   

5,5-Dithiobis[1-methylhistidine]

5,5-Dithiobis[1-methylhistidine]

C14H20N6O4S2 (400.0987)


   

6-O-acetylsweroside

6-O-acetylsweroside

C18H24O10 (400.1369)


   

dihydrolanneaflavonol

dihydrolanneaflavonol

C21H20O8 (400.1158)


   

solphenazine E

solphenazine E

C20H20N2O7 (400.127)


   

7R,7S,8S,8R-8-hydroxy-6-methoxy-3,4:3,4-bis(methylenedioxy)-7,9:7,9-diepoxylignan|palatiferin A

7R,7S,8S,8R-8-hydroxy-6-methoxy-3,4:3,4-bis(methylenedioxy)-7,9:7,9-diepoxylignan|palatiferin A

C21H20O8 (400.1158)


   

methyl 3-O-methylvariegatate

methyl 3-O-methylvariegatate

C20H16O9 (400.0794)


   

dehydrokuanoniamine F

dehydrokuanoniamine F

C23H20N4OS (400.1358)


   
   
   

Homalicin|Homalicine

Homalicin|Homalicine

C21H20O8 (400.1158)


   

Interruptin A

Interruptin A

C25H20O5 (400.1311)


   

Regaloside H

Regaloside H

C18H24O10 (400.1369)


Regaloside H is a natural product found in Lilium auratum, Lilium pensylvanicum, and Lilium mackliniae with data available. Regaloside H, a phenylpropanoid glycerol glucoside, is a gluconeogenesis inhibitor. Regaloside H can reduce glucose production in Hepatocytes[1].

   

2(E)-O-feruloyl-4-O-methoxyglucaric acid

2(E)-O-feruloyl-4-O-methoxyglucaric acid

C17H20O11 (400.1006)


   
   

3,3-bis-(1,1-dimethyl-2,2-dioxo-4,4-dimethoxy-5,5-dihydroxy-5,5-dimethoxycarbonyl-3-pyrroline)

3,3-bis-(1,1-dimethyl-2,2-dioxo-4,4-dimethoxy-5,5-dihydroxy-5,5-dimethoxycarbonyl-3-pyrroline)

C16H20N2O10 (400.1118)


   
   

(10R*,11S*)-11-bromo-10-hydroxychromomoric acid F methyl ester

(10R*,11S*)-11-bromo-10-hydroxychromomoric acid F methyl ester

C19H29BrO4 (400.1249)


   

4-O-acetyl-3,4-deoxypsorospermin-3,4-diol

4-O-acetyl-3,4-deoxypsorospermin-3,4-diol

C21H20O8 (400.1158)


   

Calomelanol H

Calomelanol H

C24H16O6 (400.0947)


   
   

Regaloside A

[(2S)-2-hydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl] (E)-3-(4-hydroxyphenyl)prop-2-enoate

C18H24O10 (400.1369)


Regaloside A is a natural product found in Lilium tenuifolium, Lilium auratum, and other organisms with data available. Regaloside A, a phenylpropanoid, shows significant DPPH radical scavenging activity of 58.0\\% at 160 ppm. Regaloside A has anti-inflammatory activity[1]. Regaloside A, a phenylpropanoid, shows significant DPPH radical scavenging activity of 58.0\% at 160 ppm. Regaloside A has anti-inflammatory activity[1].

   

5-hydroxy-6,8-dimethoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one

NCGC00380471-01!5-hydroxy-6,8-dimethoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one

C17H20O11 (400.1006)


   

4-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one

NCGC00161931-02!4-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one

C21H20O8 (400.1158)


   

NCGC00169067-03!

NCGC00169067-03!

C21H20O8 (400.1158)


   

5-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one

NCGC00095300-04!5-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one

C21H20O8 (400.1158)


   

C18H21ClO8_1H-2-Benzoxacyclotetradecin-1,11(12H)-dione, 13-chloro-3,4,5,8,9,10-hexahydro-5,8,9,14,16-pentahydroxy-3-methyl-, (6E)

NCGC00381414-01_C18H21ClO8_1H-2-Benzoxacyclotetradecin-1,11(12H)-dione, 13-chloro-3,4,5,8,9,10-hexahydro-5,8,9,14,16-pentahydroxy-3-methyl-, (6E)-

C18H21ClO8 (400.0925)


   

4-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one

4-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one

C21H20O8 (400.1158)


   

3,8-dihydroxy-7,14-dimethoxy-17-methyl-12,16,21-trioxapentacyclo[15.3.1.0²,¹⁵.0⁴,¹³.0⁶,¹¹]henicosa-2,4(13),6,8,10,14-hexaen-5-one

3,8-dihydroxy-7,14-dimethoxy-17-methyl-12,16,21-trioxapentacyclo[15.3.1.0²,¹⁵.0⁴,¹³.0⁶,¹¹]henicosa-2,4(13),6,8,10,14-hexaen-5-one

C21H20O8 (400.1158)


   

Zuclopenthixol

Zuclopenthixol

C22H25ClN2OS (400.1376)


D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents N - Nervous system > N05 - Psycholeptics > N05A - Antipsychotics > N05AF - Thioxanthene derivatives D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents > D018492 - Dopamine Antagonists D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent Zuclopenthixol ((Z)-Clopenthixol) is a thioxanthene derivative which acts as a mixed dopamine D1/D2 receptor antagonist[1][2].

   

4-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one [IIN-based: Match]

NCGC00161931-02!4-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one [IIN-based: Match]

C21H20O8 (400.1158)


   

4-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one [IIN-based on: CCMSLIB00000845720]

NCGC00161931-02!4-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one [IIN-based on: CCMSLIB00000845720]

C21H20O8 (400.1158)


   

5-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one [IIN-based on: CCMSLIB00000847323]

NCGC00095300-04!5-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one [IIN-based on: CCMSLIB00000847323]

C21H20O8 (400.1158)


   

5-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one [IIN-based: Match]

NCGC00095300-04!5-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one [IIN-based: Match]

C21H20O8 (400.1158)


   

4-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one_major

4-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one_major

C21H20O8 (400.1158)


   

3,8-dihydroxy-7,14-dimethoxy-17-methyl-12,16,21-trioxapentacyclo[15.3.1.0²,¹⁵.0⁴,¹³.0⁶,¹¹]henicosa-2,4(13),6,8,10,14-hexaen-5-one_major

3,8-dihydroxy-7,14-dimethoxy-17-methyl-12,16,21-trioxapentacyclo[15.3.1.0²,¹⁵.0⁴,¹³.0⁶,¹¹]henicosa-2,4(13),6,8,10,14-hexaen-5-one_major

C21H20O8 (400.1158)


   

3,8-dihydroxy-7,14-dimethoxy-17-methyl-12,16,21-trioxapentacyclo[15.3.1.0²,¹?.0?,¹³.0?,¹¹]henicosa-2,4(13),6,8,10,14-hexaen-5-one

3,8-dihydroxy-7,14-dimethoxy-17-methyl-12,16,21-trioxapentacyclo[15.3.1.0²,¹?.0?,¹³.0?,¹¹]henicosa-2,4(13),6,8,10,14-hexaen-5-one

C21H20O8 (400.1158)


   

Carbamazepine N-Glucuronide

Carbamazepine N-Glucuronide

C20H20N2O7 (400.127)


   

4-Demethylepipodophyllotoxin

4-Demethylepipodophyllotoxin

C21H20O8 (400.1158)


4'-Demethylepipodophyllotoxin (4'-DMEP) is an intermediate compound that inhibits microtubule assembly. 4'-Demethylepipodophyllotoxin (4'-DMEP) is an intermediate compound that inhibits microtubule assembly.

   

Elesclomol

1,3-bis[2-methyl-2-(phenylthioxomethyl)hydrazide]-propanedioic acid

C19H20N4O2S2 (400.1028)


C274 - Antineoplastic Agent > C177298 - Mitochondrial Targeting Antineoplastic Agent

   

7-Deoxy-13-dihydroadriamycinone

7-Deoxy-13-dihydroadriamycinone

C21H20O8 (400.1158)


   

4-O-Demethyladriamycinone

4-O-Demethyladriamycinone

C20H16O9 (400.0794)


   

Daunorubicinol aglycone

Daunorubicinol aglycone

C21H20O8 (400.1158)


   

Theaflagallin

2,3,4,6-tetrahydroxy-8-(3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)-5H-benzo[7]annulen-5-one

C20H16O9 (400.0794)


   

Propiomazine HCL

2-phenyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-one

C21H20O8 (400.1158)


   

5-Hydroxy-6,8-dimethoxy-2-oxo-2H-chromen-7-yl ?-D-glucopyranoside

5-Hydroxy-6,8-dimethoxy-2-oxo-2H-chromen-7-yl ?-D-glucopyranoside

C17H20O11 (400.1006)


   

3-hydroxypropyl(triphenyl)phosphanium,bromide

3-hydroxypropyl(triphenyl)phosphanium,bromide

C21H22BrOP (400.0592)


   

ethyl 2-[[4-bromo-3-(phenylmethoxycarbonylamino)butanoyl]amino]acetate

ethyl 2-[[4-bromo-3-(phenylmethoxycarbonylamino)butanoyl]amino]acetate

C16H21BrN2O5 (400.0634)


   

2-Phenyl-2-imidazoline pyromellitate

2-Phenyl-2-imidazoline pyromellitate

C19H16N2O8 (400.0907)


   

6-Amino-9H-purin-2-ol sulfate (2:1)

6-Amino-9H-purin-2-ol sulfate (2:1)

C10H12N10O6S (400.0662)


   

Tetraphenyl orthosilicate

Tetraphenyl orthosilicate

C24H20O4Si (400.1131)


   

Thiazolidine, 3-(1-naphthalenylsulfonyl)-2-(3-nitrophenyl)- (9CI)

Thiazolidine, 3-(1-naphthalenylsulfonyl)-2-(3-nitrophenyl)- (9CI)

C19H16N2O4S2 (400.0551)


   

2-(3-(benzo[d]thiazol-2-yl)phenyl)-1,3-dioxoisoindoline-5-carboxylic acid

2-(3-(benzo[d]thiazol-2-yl)phenyl)-1,3-dioxoisoindoline-5-carboxylic acid

C22H12N2O4S (400.0518)


   

2(or 4)-(isopropyl)benzenesulphonic acid

2(or 4)-(isopropyl)benzenesulphonic acid

C18H24O6S2 (400.1014)


   

6,7-Bis(benzyloxy)-4-hydroxy-2-naphthoic acid

6,7-Bis(benzyloxy)-4-hydroxy-2-naphthoic acid

C25H20O5 (400.1311)


   

N-(4-((4-CHLORO-6-((5-METHYL-1H-PYRAZOL-3-YL)AMINO)PYRIMIDIN-2-YL)THIO)PHENYL)CYCLOPROPANECARBOXAMIDE

N-(4-((4-CHLORO-6-((5-METHYL-1H-PYRAZOL-3-YL)AMINO)PYRIMIDIN-2-YL)THIO)PHENYL)CYCLOPROPANECARBOXAMIDE

C18H17ClN6OS (400.0873)


   
   

3,5-bis[(4-azidophenyl)methylidene]-4-oxocyclohexane-1-carboxylic acid

3,5-bis[(4-azidophenyl)methylidene]-4-oxocyclohexane-1-carboxylic acid

C21H16N6O3 (400.1284)


   

Copper tripeptide

Copper tripeptide

C14H21CuN6O4 (400.092)


   

Urea, N-[2-(trifluoromethyl)-1,8-naphthyridin-3-yl]-N-[3-(trifluoromethyl)phenyl]- (9CI)

Urea, N-[2-(trifluoromethyl)-1,8-naphthyridin-3-yl]-N-[3-(trifluoromethyl)phenyl]- (9CI)

C17H10F6N4O (400.0759)


   

1-Naphthalenesulfonicacid, 5-[2-(2-hydroxy-1-naphthalenyl)diazenyl]-, sodium salt (1:1)

1-Naphthalenesulfonicacid, 5-[2-(2-hydroxy-1-naphthalenyl)diazenyl]-, sodium salt (1:1)

C20H13N2NaO4S (400.0494)


   

rhodamine 123 hydrate

rhodamine 123 hydrate

C21H21ClN2O4 (400.119)


   
   

cadmium bis(2-ethylhexanoate)

cadmium bis(2-ethylhexanoate)

C16H30CdO4 (400.1178)


   

5-NITRO-2-(4-(5-NITRO-1H-BENZO[D]IMIDAZOL-2-YL)PHENYL)-1H-BENZO[D]IMIDAZOLE

5-NITRO-2-(4-(5-NITRO-1H-BENZO[D]IMIDAZOL-2-YL)PHENYL)-1H-BENZO[D]IMIDAZOLE

C20H12N6O4 (400.092)


   

6-fluoro-1-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)-4-oxo-1,8-naphthyridine-3-carboxylic acid

6-fluoro-1-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)-4-oxo-1,8-naphthyridine-3-carboxylic acid

C20H18F2N4O3 (400.1347)


   

6-fluoro-1-(4-fluorophenyl)-7-(3-methylpiperazin-1-yl)-4-oxo-1,8-naphthyridine-3-carboxylic acid

6-fluoro-1-(4-fluorophenyl)-7-(3-methylpiperazin-1-yl)-4-oxo-1,8-naphthyridine-3-carboxylic acid

C20H18F2N4O3 (400.1347)


   

bis(diphenylphosphino)methane monooxide

bis(diphenylphosphino)methane monooxide

C25H22OP2 (400.1146)


   
   

cadmium isooctanoate

cadmium isooctanoate

C16H30CdO4 (400.1178)


   

5-IODO-1-TRIISOPROPYLSILANYL-1H-PYRROLO[2,3-B]PYRIDINE

5-IODO-1-TRIISOPROPYLSILANYL-1H-PYRROLO[2,3-B]PYRIDINE

C16H25IN2Si (400.0832)


   

(6-hydroxy-3-oxospiro[2-benzofuran-1,9-xanthene]-3-yl) 2-methylprop-2-enoate

(6-hydroxy-3-oxospiro[2-benzofuran-1,9-xanthene]-3-yl) 2-methylprop-2-enoate

C24H16O6 (400.0947)


   
   

(R)-AZIDOPHENYLACETICACID

(R)-AZIDOPHENYLACETICACID

C25H21O3P (400.1228)


   

3-IODO-1-TRIISOPROPYLSILANYL-1H-PYRROLO[2,3-B]PYRIDINE

3-IODO-1-TRIISOPROPYLSILANYL-1H-PYRROLO[2,3-B]PYRIDINE

C16H25IN2Si (400.0832)


   
   

Rosabulin

Rosabulin

C22H16N4O2S (400.0994)


C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C273 - Antimitotic Agent

   

2,3,7,8-Tetraacetoxydibenzofuran

2,3,7,8-Tetraacetoxydibenzofuran

C20H16O9 (400.0794)


   

5,6-DIAMINO-2,4-DIHYDROXYPYRIMIDINE SULFATE DIHYDRATE

5,6-DIAMINO-2,4-DIHYDROXYPYRIMIDINE SULFATE DIHYDRATE

C8H16N8O9S (400.0761)


   

TRICIRIBINE PHOSPHATE

1,4,5,6,8-Pentaazaacenaphthylen-3-amine

C13H17N6O7P (400.0896)


C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite C471 - Enzyme Inhibitor > C2087 - Inosine Monophosphate Dehydrogenase Inhibitor C471 - Enzyme Inhibitor > C2254 - Amidophosphoribosyltransferase Inhibitor

   

METHYL 4-(4-[(4-METHOXYBENZOYL)AMINO]-3-NITROPHENYL)-3-METHYL-4-OXOBUTANOATE

METHYL 4-(4-[(4-METHOXYBENZOYL)AMINO]-3-NITROPHENYL)-3-METHYL-4-OXOBUTANOATE

C20H20N2O7 (400.127)


   

4-chlorophenylguanidine carbonate

4-chlorophenylguanidine carbonate

C15H18Cl2N6O3 (400.0817)


   

2,2-BIPYRIDINIUM-N,N-DI(PROPYLSULFONATE)

2,2-BIPYRIDINIUM-N,N-DI(PROPYLSULFONATE)

C16H20N2O6S2 (400.0763)


   

sodium 2-[(2-hydroxynaphthyl)azo]naphthalenesulphonate

sodium 2-[(2-hydroxynaphthyl)azo]naphthalenesulphonate

C20H13N2NaO4S (400.0494)


   
   
   

3(or5)-[[4-[benzylmethylamino]phenyl]azo]-1,2(or1,4)-dimethyl-1H-1,2,4-triazolium bromide

3(or5)-[[4-[benzylmethylamino]phenyl]azo]-1,2(or1,4)-dimethyl-1H-1,2,4-triazolium bromide

C18H21N6.Br (400.1011)


   

5α-Androst-16-en-3β-ol, 17-iodo-

5α-Androst-16-en-3β-ol, 17-iodo-

C19H29IO (400.1263)


   

ETHYL 3-(2-(CHLOROMETHYL)-1-METHYL-N-(PYRIDIN-2-YL)-1H-BENZO[D]IMIDAZOLE-5-CARBOXAMIDO)PROPANOATE

ETHYL 3-(2-(CHLOROMETHYL)-1-METHYL-N-(PYRIDIN-2-YL)-1H-BENZO[D]IMIDAZOLE-5-CARBOXAMIDO)PROPANOATE

C20H21ClN4O3 (400.1302)


   

N-(2,2-DIMETHOXYETHYL)-6-(5-(PHENYLTHIO)THIOPHEN-2-YL)NICOTINAMIDE

N-(2,2-DIMETHOXYETHYL)-6-(5-(PHENYLTHIO)THIOPHEN-2-YL)NICOTINAMIDE

C20H20N2O3S2 (400.0915)


   

Diindenoperylene

Diindenoperylene

C32H16 (400.1252)


   

4,4-Dihydrazinostilbene-2,2-disulphonic acid

4,4-Dihydrazinostilbene-2,2-disulphonic acid

C14H16N4O6S2 (400.0511)


   

P-XYLYLENEBIS(N,N-DIETHYLDITHIOCARBAMATE)

P-XYLYLENEBIS(N,N-DIETHYLDITHIOCARBAMATE)

C18H28N2S4 (400.1135)


   

8-(2-Chlorophenylamino)-2-(2,6-difluorophenylamino)-9-ethyl-9H-purine-1,7-diium

8-(2-Chlorophenylamino)-2-(2,6-difluorophenylamino)-9-ethyl-9H-purine-1,7-diium

C19H15ClF2N6 (400.1015)


   

6-Hydroxyflavone-beta-D-glucoside

6-Hydroxyflavone-beta-D-glucoside

C21H20O8 (400.1158)


   

7-Hydroxyflavone-beta-D-glucoside

7-Hydroxyflavone-beta-D-glucoside

C21H20O8 (400.1158)


   

Sordinol

CLOPENTHIXOL

C22H25ClN2OS (400.1376)


D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents N - Nervous system > N05 - Psycholeptics > N05A - Antipsychotics > N05AF - Thioxanthene derivatives D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents > D018492 - Dopamine Antagonists D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants C78272 - Agent Affecting Nervous System > C66883 - Dopamine Antagonist

   
   

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

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

C23H16N2O3S (400.0882)


   

Purpurquinone C

Purpurquinone C

C21H20O8 (400.1158)


An azaphilone that is 1H-isochromene-6,8(7H,8aH)-dione substituted by a prop-1-en-1-yl group at position 3, a hydroxy group at position 8a, a methyl group at position 7 and a (2,4-dihydroxy-6-methylbenzoyl)oxy group at position 7. It has been isolated from Penicillium purpurogenum.

   
   

1-(1,5-Dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-(4-methylphenyl)sulfonylurea

1-(1,5-Dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-(4-methylphenyl)sulfonylurea

C19H20N4O4S (400.1205)


   

2-[[3-(4-chlorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]thio]-N-(5-methyl-3-isoxazolyl)acetamide

2-[[3-(4-chlorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]thio]-N-(5-methyl-3-isoxazolyl)acetamide

C17H13ClN6O2S (400.0509)


   

2-chloro-1-{5-[4-(difluoromethoxy)-3-methoxyphenyl]-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl}ethan-1-one

2-chloro-1-{5-[4-(difluoromethoxy)-3-methoxyphenyl]-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl}ethan-1-one

C17H15ClF2N2O3S (400.046)


   

4-(1,3-dioxo-2-benzo[de]isoquinolinyl)-N-(1,1-dioxo-3-thiolanyl)butanamide

4-(1,3-dioxo-2-benzo[de]isoquinolinyl)-N-(1,1-dioxo-3-thiolanyl)butanamide

C20H20N2O5S (400.1093)


   

2-(6-bromo-2-methyl-4-oxo-1-quinolinyl)-N-(2-methoxyphenyl)acetamide

2-(6-bromo-2-methyl-4-oxo-1-quinolinyl)-N-(2-methoxyphenyl)acetamide

C19H17BrN2O3 (400.0422)


   

2-[[3-(4-methoxyphenyl)-7-triazolo[4,5-d]pyrimidinyl]thio]-N-(2-oxolanylmethyl)acetamide

2-[[3-(4-methoxyphenyl)-7-triazolo[4,5-d]pyrimidinyl]thio]-N-(2-oxolanylmethyl)acetamide

C18H20N6O3S (400.1318)


   

1-Methyl-5-(2-phenoxymethyl-pyrrolidine-1-sulfonyl)-1h-indole-2,3-dione

1-Methyl-5-(2-phenoxymethyl-pyrrolidine-1-sulfonyl)-1h-indole-2,3-dione

C20H20N2O5S (400.1093)


   

3-(9-hydroxy-1,3-dioxo-4-phenyl-2,3-dihydropyrrolo[3,4-c]carbazol-6(1H)-yl)propanoic acid

3-(9-hydroxy-1,3-dioxo-4-phenyl-2,3-dihydropyrrolo[3,4-c]carbazol-6(1H)-yl)propanoic acid

C23H16N2O5 (400.1059)


   

(1S)-1-(3-chlorophenyl)-2-oxo-2-[(1,3,4-trioxo-1,2,3,4-tetrahydroisoquinolin-5-yl)amino]ethyl acetate

(1S)-1-(3-chlorophenyl)-2-oxo-2-[(1,3,4-trioxo-1,2,3,4-tetrahydroisoquinolin-5-yl)amino]ethyl acetate

C19H13ClN2O6 (400.0462)


   

AIDS-006790

Furo(3,4:6,7)naphtho(2,3-d)-1,3-dioxol-6(5ah)-one, 5,8,8a,9-tetrahydro-9-hydroxy-5-(4-hydroxy-3,5-dimethoxyphenyl)-, (5R-(5-alpha,5a-beta,8a-alpha,9-alpha))-

C21H20O8 (400.1158)


4'-Demethylpodophyllotoxin is an aryltetralin lignin contained in the root of Podophyllum hexandrum and P. peltatum. 4'-Demethylpodophyllotoxin exhibits cytotoxic potential in diverse cancer cell lines[1][2]. 4'-Demethylpodophyllotoxin is an aryltetralin lignin contained in the root of Podophyllum hexandrum and P. peltatum. 4'-Demethylpodophyllotoxin exhibits cytotoxic potential in diverse cancer cell lines[1][2].

   

5-(3',4',5'-Trihydroxyphenyl)-gamma-valerolactone-3'-O-glucuronide

(2S,3S,4S,5R)-6-{2,3-dihydroxy-5-[(5-oxooxolan-2-yl)methyl]phenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

C17H20O11 (400.1006)


5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone-3-O-glucuronide is a conjugate of 5-(3,4,5-trihydroxyphenyl)-gamma-valerolactone and glucuronide. A glucuronide, also known as glucuronoside, is any substance produced by linking glucuronic acid to another substance via a glycosidic bond. The glucuronides belong to the glycosides. (Wikipedia)

   

5-(3',4',5'-Trihydroxyphenyl)-gamma-valerolactone-4'-O-glucuronide

(2S,3S,4S,5R,6S)-6-{2,6-dihydroxy-4-[(5-oxooxolan-2-yl)methyl]phenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

C17H20O11 (400.1006)


5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone-4-O-glucuronide is a conjugate of 5-(3,4,5-trihydroxyphenyl)-gamma-valerolactone and glucuronide. A glucuronide, also known as glucuronoside, is any substance produced by linking glucuronic acid to another substance via a glycosidic bond. The glucuronides belong to the glycosides. (Wikipedia)

   

3,8-Dihydroxy-7,14-dimethoxy-17-methyl-12,16,21-trioxapentacyclo[15.3.1.02,15.04,13.06,11]henicosa-2(15),3,6(11),7,9,13-hexaen-5-one

3,8-Dihydroxy-7,14-dimethoxy-17-methyl-12,16,21-trioxapentacyclo[15.3.1.02,15.04,13.06,11]henicosa-2(15),3,6(11),7,9,13-hexaen-5-one

C21H20O8 (400.1158)


   

4-hydroxy-9-(4-hydroxy-3,5-dimethoxy-phenyl)-5a,6,8a,9-tetrahydro-5H-isobenzofuro[6,5-f][1,3]benzodioxol-8-one

4-hydroxy-9-(4-hydroxy-3,5-dimethoxy-phenyl)-5a,6,8a,9-tetrahydro-5H-isobenzofuro[6,5-f][1,3]benzodioxol-8-one

C21H20O8 (400.1158)


   

Oxacillin(1-)

Oxacillin(1-)

C19H18N3O5S- (400.0967)


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

   

Welwitindolinone B isothiocyanate

Welwitindolinone B isothiocyanate

C21H21ClN2O2S (400.1012)


   

grixazone A(1-)

grixazone A(1-)

C18H14N3O6S- (400.0603)


An L-alpha-amino-acid anion that is the conjugate base of grixazone A, obtained by deprotonation of the carboxy group.

   

9,10-Anthracenedione, 2-(3-(acetyloxy)-1-(hydroxymethyl)propyl)-1,3,6,8-tetrahydroxy-, (-)-

9,10-Anthracenedione, 2-(3-(acetyloxy)-1-(hydroxymethyl)propyl)-1,3,6,8-tetrahydroxy-, (-)-

C20H16O9-2 (400.0794)


   

Demethylpremithracinone

Demethylpremithracinone

C20H16O9 (400.0794)


   

N-[2-(carboxylatoamino)-1,2-bis(1H-indol-3-yl)ethyl]carbamate

N-[2-(carboxylatoamino)-1,2-bis(1H-indol-3-yl)ethyl]carbamate

C22H16N4O4-2 (400.1171)


   

Desmethylanthrotainin

Desmethylanthrotainin

C19H14NO9- (400.0669)


   

Methyl(5-adenosyl)(3-hydroxy-3-carboxylatopropyl)sulfonium

Methyl(5-adenosyl)(3-hydroxy-3-carboxylatopropyl)sulfonium

C15H22N5O6S+ (400.1291)


   

[1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyindol-3-yl]methylcarbamodithioic acid

[1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyindol-3-yl]methylcarbamodithioic acid

C16H20N2O6S2 (400.0763)


   

[(4S,5R,6S,8S,10R)-10-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]-5-methyl-2,11-diaza-12-azoniatricyclo[6.3.1.04,12]dodec-1(12)-en-6-yl] hydrogen sulfate

[(4S,5R,6S,8S,10R)-10-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]-5-methyl-2,11-diaza-12-azoniatricyclo[6.3.1.04,12]dodec-1(12)-en-6-yl] hydrogen sulfate

C15H22N5O6S+ (400.1291)


   

S-[2-[3-[[(2R)-2-hydroxy-4-methyl-4-phosphonooxypentanoyl]amino]propanoylamino]ethyl] ethanethioate

S-[2-[3-[[(2R)-2-hydroxy-4-methyl-4-phosphonooxypentanoyl]amino]propanoylamino]ethyl] ethanethioate

C13H25N2O8PS (400.1069)


   

2,3,4,6-tetrahydroxy-8-(3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl)benzo[7]annulen-5-one

2,3,4,6-tetrahydroxy-8-(3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl)benzo[7]annulen-5-one

C20H16O9 (400.0794)


   

Sinapic acid glucuronide

Sinapic acid glucuronide

C17H20O11 (400.1006)


   

2,6-Bis(2-hydroxyphenyl)pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone

2,6-Bis(2-hydroxyphenyl)pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone

C22H12N2O6 (400.0695)


   

4-[ethyl-(phenylmethyl)sulfamoyl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide

4-[ethyl-(phenylmethyl)sulfamoyl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide

C19H20N4O4S (400.1205)


   

N-(4-chlorophenyl)-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1-piperidinecarboxamide

N-(4-chlorophenyl)-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1-piperidinecarboxamide

C20H18ClFN4O2 (400.1102)


   

5-[(5-Bromo-2-hydroxyphenyl)-oxomethyl]-1-cyclohexyl-2-oxo-3-pyridinecarbonitrile

5-[(5-Bromo-2-hydroxyphenyl)-oxomethyl]-1-cyclohexyl-2-oxo-3-pyridinecarbonitrile

C19H17BrN2O3 (400.0422)


   

3-[(2-chlorophenyl)methyl]-7-oxo-N-(thiophen-2-ylmethyl)-2H-triazolo[4,5-d]pyrimidine-5-carboxamide

3-[(2-chlorophenyl)methyl]-7-oxo-N-(thiophen-2-ylmethyl)-2H-triazolo[4,5-d]pyrimidine-5-carboxamide

C17H13ClN6O2S (400.0509)


   

4-[[2-[[5-(3-Methylanilino)-1,3,4-thiadiazol-2-yl]thio]-1-oxoethyl]amino]benzoic acid

4-[[2-[[5-(3-Methylanilino)-1,3,4-thiadiazol-2-yl]thio]-1-oxoethyl]amino]benzoic acid

C18H16N4O3S2 (400.0664)


   

N-ethyl-N-[2-[(5-nitro-8-quinolinyl)amino]ethyl]benzenesulfonamide

N-ethyl-N-[2-[(5-nitro-8-quinolinyl)amino]ethyl]benzenesulfonamide

C19H20N4O4S (400.1205)


   

3-[(4-Chlorophenyl)sulfonylamino]propanoic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester

3-[(4-Chlorophenyl)sulfonylamino]propanoic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester

C16H17ClN2O6S (400.0496)


   

2-[(4-ethoxyphenyl)sulfonylamino]-N-(2-furanylmethyl)benzamide

2-[(4-ethoxyphenyl)sulfonylamino]-N-(2-furanylmethyl)benzamide

C20H20N2O5S (400.1093)


   

1-Ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carboxylic acid (3-bromophenyl)methyl ester

1-Ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carboxylic acid (3-bromophenyl)methyl ester

C19H17BrN2O3 (400.0422)


   

ethyl 2-[7-[(Z)-3-chlorobut-2-enyl]-3-methyl-2,6-dioxopurin-8-yl]sulfanylbutanoate

ethyl 2-[7-[(Z)-3-chlorobut-2-enyl]-3-methyl-2,6-dioxopurin-8-yl]sulfanylbutanoate

C16H21ClN4O4S (400.0972)


   

4-[(Z)-(4-oxo-3-phenyl-2-phenylimino-1,3-thiazolidin-5-ylidene)methyl]benzoic acid

4-[(Z)-(4-oxo-3-phenyl-2-phenylimino-1,3-thiazolidin-5-ylidene)methyl]benzoic acid

C23H16N2O3S (400.0882)


   

N-[4-chloro-2-[(2,4-dimethoxyanilino)-oxomethyl]phenyl]-2-furancarboxamide

N-[4-chloro-2-[(2,4-dimethoxyanilino)-oxomethyl]phenyl]-2-furancarboxamide

C20H17ClN2O5 (400.0826)


   
   

Calix[5]furan

Calix[5]furan

C25H20O5 (400.1311)


   
   

(2E)-2-fatty-enoyladenylate(1-)

(2E)-2-fatty-enoyladenylate(1-)

C13H15N5O8P- (400.0658)


   

1-[5-Hydroxy-8-(2-hydroxypropan-2-yl)-2-oxo-8,9-dihydrouro[2,3-h]chromen-4-yl]propyl hydrogen sulate

1-[5-Hydroxy-8-(2-hydroxypropan-2-yl)-2-oxo-8,9-dihydrouro[2,3-h]chromen-4-yl]propyl hydrogen sulate

C17H20O9S (400.0828)


   

2-phenyl-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one

2-phenyl-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one

C21H20O8 (400.1158)


   

3,4,5-Trihydroxy-6-[5-(4-hydroxy-3-methoxyphenyl)pentanoyloxy]oxane-2-carboxylic acid

3,4,5-Trihydroxy-6-[5-(4-hydroxy-3-methoxyphenyl)pentanoyloxy]oxane-2-carboxylic acid

C18H24O10 (400.1369)


   

1-[5-Hydroxy-8-(2-hydroxypropan-2-yl)-2-oxo-8,9-dihydrouro[2,3-h]chromen-4-yl]propan-2-yl hydrogen sulate

1-[5-Hydroxy-8-(2-hydroxypropan-2-yl)-2-oxo-8,9-dihydrouro[2,3-h]chromen-4-yl]propan-2-yl hydrogen sulate

C17H20O9S (400.0828)


   

3,4,5-trihydroxy-6-[3-[(E)-3-phenylprop-2-enoyl]phenoxy]oxane-2-carboxylic acid

3,4,5-trihydroxy-6-[3-[(E)-3-phenylprop-2-enoyl]phenoxy]oxane-2-carboxylic acid

C21H20O8 (400.1158)


   

(E,5S)-4,5-dihydroxy-1-(4-hydroxyphenyl)-6-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhex-1-en-3-one

(E,5S)-4,5-dihydroxy-1-(4-hydroxyphenyl)-6-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhex-1-en-3-one

C18H24O10 (400.1369)


   

3-Acetyl-4,4a,6,7,9,12a-hexahydroxy-1,12-dihydrotetracene-2,5-dione

3-Acetyl-4,4a,6,7,9,12a-hexahydroxy-1,12-dihydrotetracene-2,5-dione

C20H16O9 (400.0794)


   

Anti-5,8,13,16-tetrafluoro-4,6,12,14-tetramethoxy(2.2)metacyclophane

Anti-5,8,13,16-tetrafluoro-4,6,12,14-tetramethoxy(2.2)metacyclophane

C20H20F4O4 (400.1298)


   

Isoflavone 7-O-beta-D-glucoside

7-hydroxyisoflavone 7-O-beta-D-glucoside

C21H20O8 (400.1158)


A glycosyloxyisoflavone that is 7-hydroxyisoflavone attached to a beta-D-glucopyranosyl residue at position 7 via a glycosidic linkage.

   

(2S,3S)-versiconal hemiacetal acetate

(2S,3S)-versiconal hemiacetal acetate

C20H16O9 (400.0794)


An optically active form of versiconal hemiacetal acetate having 2S,3S-configuration.

   

(5S,5aR,8aR,9R)-5-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one

(5S,5aR,8aR,9R)-5-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one

C21H20O8 (400.1158)


   

Sinapinic acid-O-glucuronide isomer

Sinapinic acid-O-glucuronide isomer

C17H20O11 (400.1006)


   

5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone-4-O-glucuronide

5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone-4-O-glucuronide

C17H20O11 (400.1006)


   

5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone-3-O-glucuronide

5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone-3-O-glucuronide

C17H20O11 (400.1006)


   

S-acetylphosphopantotheine

S-acetylphosphopantotheine

C13H25N2O8PS (400.1069)


   

Demethylpremithramycinone

Demethylpremithramycinone

C20H16O9 (400.0794)


   
   
   
   

MRK-898

MRK-898

C20H9F5N4 (400.0747)


MRK-898 is an orally active GABA(A) receptor modulator. MRK-898 binds to α1, α2, α3 or α5 subunit of GABA(A) receptor with Ki values of 1.2 nM, 1.0 nM, 0.73 nM, and 0.50 nM, respectively. However, α1-containing GABA(A) receptors are identified as the "sedative" and α2- and/or α3-containing receptors as the "anxiolytic" subtype(s)[1].

   

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

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

C21H20O8 (400.1158)


   

(3s)-3,5,7-trihydroxy-3-[(2s)-2-(hydroxymethyl)-5-methoxy-2-methylchromen-6-yl]-2h-1-benzopyran-4-one

(3s)-3,5,7-trihydroxy-3-[(2s)-2-(hydroxymethyl)-5-methoxy-2-methylchromen-6-yl]-2h-1-benzopyran-4-one

C21H20O8 (400.1158)


   

2-hydroxy-10-(4-hydroxy-3,5-dimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one

2-hydroxy-10-(4-hydroxy-3,5-dimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one

C21H20O8 (400.1158)


   

3,5-dihydroxy-2,10-diphenyl-9h,10h-pyrano[2,3-h]chromene-4,8-dione

3,5-dihydroxy-2,10-diphenyl-9h,10h-pyrano[2,3-h]chromene-4,8-dione

C24H16O6 (400.0947)


   

methyl 6-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}phenazine-1-carboxylate

methyl 6-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}phenazine-1-carboxylate

C20H20N2O7 (400.127)


   

(1r,2r,3s,4s,5s,6s)-1-[(benzoyloxy)methyl]-2,4,5-trihydroxy-7-oxabicyclo[4.1.0]heptan-3-yl benzoate

(1r,2r,3s,4s,5s,6s)-1-[(benzoyloxy)methyl]-2,4,5-trihydroxy-7-oxabicyclo[4.1.0]heptan-3-yl benzoate

C21H20O8 (400.1158)


   

2-{[(2s,3r,4s,5r,6r)-3,4-bis(acetyloxy)-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-hydroxybenzoic acid

2-{[(2s,3r,4s,5r,6r)-3,4-bis(acetyloxy)-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-hydroxybenzoic acid

C17H20O11 (400.1006)


   

4,13,14-trihydroxy-5-methoxy-10-methyl-15-(2-oxopropyl)-11,18-dioxatetracyclo[8.7.1.0²,⁸.0¹²,¹⁷]octadeca-2(8),4,6,12(17),13,15-hexaen-3-one

4,13,14-trihydroxy-5-methoxy-10-methyl-15-(2-oxopropyl)-11,18-dioxatetracyclo[8.7.1.0²,⁸.0¹²,¹⁷]octadeca-2(8),4,6,12(17),13,15-hexaen-3-one

C21H20O8 (400.1158)


   

(5r)-5-[(2r,3r)-2,3-dihydroxy-2-methyl-4-({7-oxofuro[3,2-g]chromen-9-yl}oxy)butyl]-3-methyl-5h-furan-2-one

(5r)-5-[(2r,3r)-2,3-dihydroxy-2-methyl-4-({7-oxofuro[3,2-g]chromen-9-yl}oxy)butyl]-3-methyl-5h-furan-2-one

C21H20O8 (400.1158)


   

(3e)-7,8-dihydroxy-3-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-6-(hydroxymethyl)-tetrahydro-4ah-pyrano[3,2-b][1,4]oxathiin-2-one

(3e)-7,8-dihydroxy-3-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-6-(hydroxymethyl)-tetrahydro-4ah-pyrano[3,2-b][1,4]oxathiin-2-one

C17H20O9S (400.0828)


   

(3s,3ar,4r,8r,11ar)-8-(acetyloxy)-3-(chloromethyl)-3-hydroxy-6,10-dimethyl-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl acetate

(3s,3ar,4r,8r,11ar)-8-(acetyloxy)-3-(chloromethyl)-3-hydroxy-6,10-dimethyl-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl acetate

C19H25ClO7 (400.1289)


   

16-hydroxy-10-(4-hydroxy-3-methoxyphenyl)-2-methoxy-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one

16-hydroxy-10-(4-hydroxy-3-methoxyphenyl)-2-methoxy-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one

C21H20O8 (400.1158)


   

(2s)-3-hydroxy-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

(2s)-3-hydroxy-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

C18H24O10 (400.1369)


   

(10r,11r,15r,16r)-16-hydroxy-10-(4-hydroxy-3-methoxyphenyl)-2-methoxy-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one

(10r,11r,15r,16r)-16-hydroxy-10-(4-hydroxy-3-methoxyphenyl)-2-methoxy-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one

C21H20O8 (400.1158)


   

3-(4-hydroxy-3,5-dimethoxyphenyl)-5-methoxy-2-methyl-2h,3h-[1,4]dioxino[2,3-h]chromen-9-one

3-(4-hydroxy-3,5-dimethoxyphenyl)-5-methoxy-2-methyl-2h,3h-[1,4]dioxino[2,3-h]chromen-9-one

C21H20O8 (400.1158)


   

(2s,3s,4e,6s,7s)-2-(acetyloxy)-7-[(2s,3s)-3-(acetyloxy)-6-oxo-2,3-dihydropyran-2-yl]-6,7-dihydroxyhept-4-en-3-yl acetate

(2s,3s,4e,6s,7s)-2-(acetyloxy)-7-[(2s,3s)-3-(acetyloxy)-6-oxo-2,3-dihydropyran-2-yl]-6,7-dihydroxyhept-4-en-3-yl acetate

C18H24O10 (400.1369)


   

(2r,3s)-3-(4-hydroxy-3,5-dimethoxyphenyl)-5-methoxy-2-methyl-2h,3h-[1,4]dioxino[2,3-h]chromen-9-one

(2r,3s)-3-(4-hydroxy-3,5-dimethoxyphenyl)-5-methoxy-2-methyl-2h,3h-[1,4]dioxino[2,3-h]chromen-9-one

C21H20O8 (400.1158)


   

(2s,4e)-2-(acetyloxy)-7-[(2s,3s)-3-(acetyloxy)-6-oxo-2,3-dihydropyran-2-yl]-6,7-dihydroxyhept-4-en-3-yl acetate

(2s,4e)-2-(acetyloxy)-7-[(2s,3s)-3-(acetyloxy)-6-oxo-2,3-dihydropyran-2-yl]-6,7-dihydroxyhept-4-en-3-yl acetate

C18H24O10 (400.1369)


   

(3s,3ar,4r,8s,11as)-8-(acetyloxy)-3-(chloromethyl)-3-hydroxy-6,10-dimethyl-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl acetate

(3s,3ar,4r,8s,11as)-8-(acetyloxy)-3-(chloromethyl)-3-hydroxy-6,10-dimethyl-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl acetate

C19H25ClO7 (400.1289)


   

9-(chloromethyl)-8,9-dihydroxy-3,6-dimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl 3-hydroxy-2-methylpropanoate

9-(chloromethyl)-8,9-dihydroxy-3,6-dimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl 3-hydroxy-2-methylpropanoate

C19H25ClO7 (400.1289)


   

3-{2,4-dihydroxy-3-[(2e)-4-hydroxy-3-methylbut-2-en-1-yl]-5-methoxyphenyl}-5,7-dihydroxychromen-4-one

3-{2,4-dihydroxy-3-[(2e)-4-hydroxy-3-methylbut-2-en-1-yl]-5-methoxyphenyl}-5,7-dihydroxychromen-4-one

C21H20O8 (400.1158)


   

(2s,3s,4r,6s,8s)-4-chloro-3-ethenyl-9-hydroxy-2-isothiocyanato-3,7,7-trimethyl-10-azatetracyclo[6.6.1.1²,⁶.0¹¹,¹⁵]hexadeca-1(14),9,11(15),12-tetraen-16-one

(2s,3s,4r,6s,8s)-4-chloro-3-ethenyl-9-hydroxy-2-isothiocyanato-3,7,7-trimethyl-10-azatetracyclo[6.6.1.1²,⁶.0¹¹,¹⁵]hexadeca-1(14),9,11(15),12-tetraen-16-one

C21H21ClN2O2S (400.1012)


   

5-hydroxy-8-(4-hydroxyphenyl)-4-phenyl-3h,4h-pyrano[3,2-g]chromene-2,6-dione

5-hydroxy-8-(4-hydroxyphenyl)-4-phenyl-3h,4h-pyrano[3,2-g]chromene-2,6-dione

C24H16O6 (400.0947)


   

5-oxo-2-(1,3,6,8-tetrahydroxy-9,10-dioxoanthracen-2-yl)hexanoic acid

5-oxo-2-(1,3,6,8-tetrahydroxy-9,10-dioxoanthracen-2-yl)hexanoic acid

C20H16O9 (400.0794)


   

(1e,3s,5r,6s)-5,6-bis(acetyloxy)-5-hydroxy-1-[(2s,3s)-3-hydroxy-6-oxo-2,3-dihydropyran-2-yl]hept-1-en-3-yl acetate

(1e,3s,5r,6s)-5,6-bis(acetyloxy)-5-hydroxy-1-[(2s,3s)-3-hydroxy-6-oxo-2,3-dihydropyran-2-yl]hept-1-en-3-yl acetate

C18H24O10 (400.1369)


   

2-{[3-chloro-6,7-dihydroxy-7-(hydroxymethyl)-hexahydro-1h-cyclopenta[c]pyran-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

2-{[3-chloro-6,7-dihydroxy-7-(hydroxymethyl)-hexahydro-1h-cyclopenta[c]pyran-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C15H25ClO10 (400.1136)


   

13-chloro-5,8,9,14,16-pentahydroxy-3-methyl-4,5,8,9,10,12-hexahydro-3h-2-benzoxacyclotetradecine-1,11-dione

13-chloro-5,8,9,14,16-pentahydroxy-3-methyl-4,5,8,9,10,12-hexahydro-3h-2-benzoxacyclotetradecine-1,11-dione

C18H21ClO8 (400.0925)


   

13-hydroxy-5,17-dimethoxy-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-carbaldehyde

13-hydroxy-5,17-dimethoxy-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-carbaldehyde

C20H16O9 (400.0794)


   

5,7-dihydroxy-3-[4-hydroxy-2-(2-hydroxypropan-2-yl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]chromen-4-one

5,7-dihydroxy-3-[4-hydroxy-2-(2-hydroxypropan-2-yl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]chromen-4-one

C21H20O8 (400.1158)


   

3-(3,5-dihydroxy-6-methoxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-8-yl)-5,7-dihydroxychromen-4-one

3-(3,5-dihydroxy-6-methoxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-8-yl)-5,7-dihydroxychromen-4-one

C21H20O8 (400.1158)


   

6-(2h-1,3-benzodioxol-5-yl)-4,7,9-trimethoxy-2h-[1,3]dioxolo[4,5-g]chromen-8-one

6-(2h-1,3-benzodioxol-5-yl)-4,7,9-trimethoxy-2h-[1,3]dioxolo[4,5-g]chromen-8-one

C20H16O9 (400.0794)


   

(1r,2s,3s,6r)-3-[(benzoyloxy)methyl]-2,3,6-trihydroxy-4-oxocyclohexyl benzoate

(1r,2s,3s,6r)-3-[(benzoyloxy)methyl]-2,3,6-trihydroxy-4-oxocyclohexyl benzoate

C21H20O8 (400.1158)


   

5,7-dihydroxy-3-[(2s)-4-hydroxy-2-(2-hydroxypropan-2-yl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]chromen-4-one

5,7-dihydroxy-3-[(2s)-4-hydroxy-2-(2-hydroxypropan-2-yl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]chromen-4-one

C21H20O8 (400.1158)


   

5,7,14-trihydroxy-15-(3-hydroxy-3-methylbutyl)-13-methoxy-2,17-dioxatetracyclo[8.7.0.0³,⁸.0¹¹,¹⁶]heptadeca-1(10),3,5,7,11(16),12,14-heptaen-9-one

5,7,14-trihydroxy-15-(3-hydroxy-3-methylbutyl)-13-methoxy-2,17-dioxatetracyclo[8.7.0.0³,⁸.0¹¹,¹⁶]heptadeca-1(10),3,5,7,11(16),12,14-heptaen-9-one

C21H20O8 (400.1158)


   

3-[2,4-dihydroxy-3-(4-hydroxy-3-methylbut-2-en-1-yl)-5-methoxyphenyl]-5,7-dihydroxychromen-4-one

3-[2,4-dihydroxy-3-(4-hydroxy-3-methylbut-2-en-1-yl)-5-methoxyphenyl]-5,7-dihydroxychromen-4-one

C21H20O8 (400.1158)


   

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

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

C21H20O8 (400.1158)


   

2-(4-hydroxy-3,5-dimethoxy-phenyl)-10-methoxy-3-methyl-2,3-dihydro-1,4,5-trioxa-phenanthren-6-one

NA

C21H20O8 (400.1158)


{"Ingredient_id": "HBIN004402","Ingredient_name": "2-(4-hydroxy-3,5-dimethoxy-phenyl)-10-methoxy-3-methyl-2,3-dihydro-1,4,5-trioxa-phenanthren-6-one","Alias": "NA","Ingredient_formula": "C21H20O8","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10037","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

3'-o-β-glucopyranosyl plumbagicacid methylester

NA

C18H24O10 (400.1369)


{"Ingredient_id": "HBIN009271","Ingredient_name": "3'-o-\u03b2-glucopyranosyl plumbagicacid methylester","Alias": "NA","Ingredient_formula": "C18H24O10","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "8712","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

4-demethyl-picropodophyllotoxin

NA

C21H20O8 (400.1158)


{"Ingredient_id": "HBIN010317","Ingredient_name": "4-demethyl-picropodophyllotoxin","Alias": "NA","Ingredient_formula": "C21H20O8","Ingredient_Smile": "COC1=CC(=CC(=C1O)OC)C2C3C(COC3=O)C(C4=CC5=C(C=C24)OCO5)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5090","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

4-demethyl-podophyllotoxin

NA

C21H20O8 (400.1158)


{"Ingredient_id": "HBIN010319","Ingredient_name": "4-demethyl-podophyllotoxin","Alias": "NA","Ingredient_formula": "C21H20O8","Ingredient_Smile": "COC1=CC(=CC(=C1O)OC)C2C3C(COC3=O)C(C4=CC5=C(C=C24)OCO5)O","Ingredient_weight": "400.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5092","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "118701089","DrugBank_id": "NA"}

   

4'-demethylpodophyllotoxin; 7,8,8'-triepimer

NA

C21H20O8 (400.1158)


{"Ingredient_id": "HBIN010321","Ingredient_name": "4'-demethylpodophyllotoxin; 7,8,8'-triepimer","Alias": "NA","Ingredient_formula": "C21H20O8","Ingredient_Smile": "NA","Ingredient_weight": "0","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7848","PubChem_id": "NA","DrugBank_id": "NA"}

   

(?)-altissinone

NA

C21H20O8 (400.1158)


{"Ingredient_id": "HBIN015789","Ingredient_name": "(?)-altissinone","Alias": "NA","Ingredient_formula": "C21H20O8","Ingredient_Smile": "COC1=C(C=CC2=C1OCO2)C(=O)C3COC(C3CO)C4=CC5=C(C=C4)OCO5","Ingredient_weight": "400.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1009","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "11632717","DrugBank_id": "NA"}

   

[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[(1-hydroxypropan-2-yl)oxy]oxan-2-yl]methyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[(1-hydroxypropan-2-yl)oxy]oxan-2-yl]methyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

C18H24O10 (400.1369)


   

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

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

C20H16O9 (400.0794)


   

3-[(3r)-3,5-dihydroxy-6-methoxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-8-yl]-5,7-dihydroxychromen-4-one

3-[(3r)-3,5-dihydroxy-6-methoxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-8-yl]-5,7-dihydroxychromen-4-one

C21H20O8 (400.1158)


   

3-[(benzoyloxy)methyl]-2,3,6-trihydroxy-4-oxocyclohexyl benzoate

3-[(benzoyloxy)methyl]-2,3,6-trihydroxy-4-oxocyclohexyl benzoate

C21H20O8 (400.1158)


   

14-ethoxy-5,18-dihydroxy-7,12-dimethyl-9,16-dioxo-2,10,15-trioxatetracyclo[9.7.0.0³,⁸.0¹³,¹⁷]octadeca-1(11),3,5,7,12,17-hexaene-4-carbaldehyde

14-ethoxy-5,18-dihydroxy-7,12-dimethyl-9,16-dioxo-2,10,15-trioxatetracyclo[9.7.0.0³,⁸.0¹³,¹⁷]octadeca-1(11),3,5,7,12,17-hexaene-4-carbaldehyde

C20H16O9 (400.0794)


   

methyl 6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]phenazine-1-carboxylate

methyl 6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]phenazine-1-carboxylate

C20H20N2O7 (400.127)


   

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

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

C21H20O8 (400.1158)


   

(3s,3ar,4r,8s,11ar)-8-(acetyloxy)-3-(chloromethyl)-3-hydroxy-6,10-dimethyl-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl acetate

(3s,3ar,4r,8s,11ar)-8-(acetyloxy)-3-(chloromethyl)-3-hydroxy-6,10-dimethyl-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl acetate

C19H25ClO7 (400.1289)


   

4-(acetyloxy)-7-[3-(acetyloxy)-6-oxo-2,3-dihydropyran-2-yl]-3,7-dihydroxyhept-5-en-2-yl acetate

4-(acetyloxy)-7-[3-(acetyloxy)-6-oxo-2,3-dihydropyran-2-yl]-3,7-dihydroxyhept-5-en-2-yl acetate

C18H24O10 (400.1369)


   

(3s,6r,7r,8r,10s,13s,22r)-6,7,13,18,22-pentahydroxy-2,4,9,11,15-pentaoxatetracyclo[15.3.1.1¹⁰,¹³.0³,⁸]docosa-1(20),17(21),18-trien-16-one

(3s,6r,7r,8r,10s,13s,22r)-6,7,13,18,22-pentahydroxy-2,4,9,11,15-pentaoxatetracyclo[15.3.1.1¹⁰,¹³.0³,⁸]docosa-1(20),17(21),18-trien-16-one

C17H20O11 (400.1006)


   

3-(4-hydroxyphenyl)-7-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}chromen-4-one

3-(4-hydroxyphenyl)-7-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}chromen-4-one

C21H20O8 (400.1158)


   

8-(acetyloxy)-3-(chloromethyl)-3-hydroxy-6,10-dimethyl-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl acetate

8-(acetyloxy)-3-(chloromethyl)-3-hydroxy-6,10-dimethyl-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl acetate

C19H25ClO7 (400.1289)


   

3-[(3s)-3,8-dihydroxy-7-methoxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-5-yl]-5,7-dihydroxychromen-4-one

3-[(3s)-3,8-dihydroxy-7-methoxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-5-yl]-5,7-dihydroxychromen-4-one

C21H20O8 (400.1158)


   

(1s,2r,11r,12s)-6,7,16,17,21-pentahydroxy-11,21-dimethyl-10,20-dioxapentacyclo[10.7.2.0²,¹¹.0³,⁸.0¹³,¹⁹]henicosa-3(8),4,6,13(19),14,16-hexaen-18-one

(1s,2r,11r,12s)-6,7,16,17,21-pentahydroxy-11,21-dimethyl-10,20-dioxapentacyclo[10.7.2.0²,¹¹.0³,⁸.0¹³,¹⁹]henicosa-3(8),4,6,13(19),14,16-hexaen-18-one

C21H20O8 (400.1158)


   

(1r,2r,3s,4r,5s,9r)-5-acetyl-3,4,5,17-tetrahydroxy-8,8-dimethyl-19-oxa-7,16-diazahexacyclo[9.6.1.1¹,⁴.0²,⁹.0³,⁷.0¹⁵,¹⁸]nonadeca-11,13,15(18),16-tetraen-6-one

(1r,2r,3s,4r,5s,9r)-5-acetyl-3,4,5,17-tetrahydroxy-8,8-dimethyl-19-oxa-7,16-diazahexacyclo[9.6.1.1¹,⁴.0²,⁹.0³,⁷.0¹⁵,¹⁸]nonadeca-11,13,15(18),16-tetraen-6-one

C20H20N2O7 (400.127)


   

1,4-bis(2h-1,3-benzodioxol-5-yl)-4-methoxy-tetrahydrofuro[3,4-c]furan-3a-ol

1,4-bis(2h-1,3-benzodioxol-5-yl)-4-methoxy-tetrahydrofuro[3,4-c]furan-3a-ol

C21H20O8 (400.1158)


   

3-hydroxy-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl 3-(4-hydroxyphenyl)prop-2-enoate

3-hydroxy-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl 3-(4-hydroxyphenyl)prop-2-enoate

C18H24O10 (400.1369)


   

(2s,3s,4e,6r,7s)-2-(acetyloxy)-7-[(2s,3s)-3-(acetyloxy)-6-oxo-2,3-dihydropyran-2-yl]-6,7-dihydroxyhept-4-en-3-yl acetate

(2s,3s,4e,6r,7s)-2-(acetyloxy)-7-[(2s,3s)-3-(acetyloxy)-6-oxo-2,3-dihydropyran-2-yl]-6,7-dihydroxyhept-4-en-3-yl acetate

C18H24O10 (400.1369)


   

methyl 3-(3,5-dimethoxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoate

methyl 3-(3,5-dimethoxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoate

C18H24O10 (400.1369)


   

(5r)-5-[(2r,3r)-2,3-dihydroxy-2-methyl-4-({7-oxofuro[3,2-g]chromen-4-yl}oxy)butyl]-3-methyl-5h-furan-2-one

(5r)-5-[(2r,3r)-2,3-dihydroxy-2-methyl-4-({7-oxofuro[3,2-g]chromen-4-yl}oxy)butyl]-3-methyl-5h-furan-2-one

C21H20O8 (400.1158)


   

(2s,4r,5r,6r)-6-[(1r)-1,2-dihydroxyethyl]-2,5-dihydroxy-4-{[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxane-2-carboxylic acid

(2s,4r,5r,6r)-6-[(1r)-1,2-dihydroxyethyl]-2,5-dihydroxy-4-{[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxane-2-carboxylic acid

C14H24O13 (400.1217)


   

5-acetyl-3,4,5,17-tetrahydroxy-8,8-dimethyl-19-oxa-7,16-diazahexacyclo[9.6.1.1¹,⁴.0²,⁹.0³,⁷.0¹⁵,¹⁸]nonadeca-11,13,15(18),16-tetraen-6-one

5-acetyl-3,4,5,17-tetrahydroxy-8,8-dimethyl-19-oxa-7,16-diazahexacyclo[9.6.1.1¹,⁴.0²,⁹.0³,⁷.0¹⁵,¹⁸]nonadeca-11,13,15(18),16-tetraen-6-one

C20H20N2O7 (400.127)


   

methyl (2e)-3-(3,5-dimethoxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoate

methyl (2e)-3-(3,5-dimethoxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoate

C18H24O10 (400.1369)


   

(4s)-5-hydroxy-8-(4-hydroxyphenyl)-4-phenyl-3h,4h-pyrano[3,2-g]chromene-2,6-dione

(4s)-5-hydroxy-8-(4-hydroxyphenyl)-4-phenyl-3h,4h-pyrano[3,2-g]chromene-2,6-dione

C24H16O6 (400.0947)


   

7,9-dimethoxy-6-(7-methoxy-2h-1,3-benzodioxol-5-yl)-2h-[1,3]dioxolo[4,5-g]chromen-8-one

7,9-dimethoxy-6-(7-methoxy-2h-1,3-benzodioxol-5-yl)-2h-[1,3]dioxolo[4,5-g]chromen-8-one

C20H16O9 (400.0794)


   

α peltatin

α peltatin

C21H20O8 (400.1158)


   

5,7-dihydroxy-3-[(2s)-4-hydroxy-2-(2-hydroxypropan-2-yl)-5-methoxy-2,3-dihydro-1-benzofuran-7-yl]chromen-4-one

5,7-dihydroxy-3-[(2s)-4-hydroxy-2-(2-hydroxypropan-2-yl)-5-methoxy-2,3-dihydro-1-benzofuran-7-yl]chromen-4-one

C21H20O8 (400.1158)


   

(6r,7r)-3-[(acetyloxy)methyl]-7-[(5-carboxy-1-hydroxypentylidene)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

(6r,7r)-3-[(acetyloxy)methyl]-7-[(5-carboxy-1-hydroxypentylidene)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

C16H20N2O8S (400.094)


   

(2s)-5-oxo-2-(1,3,6,8-tetrahydroxy-9,10-dioxoanthracen-2-yl)hexanoic acid

(2s)-5-oxo-2-(1,3,6,8-tetrahydroxy-9,10-dioxoanthracen-2-yl)hexanoic acid

C20H16O9 (400.0794)


   

6,7,16,17,21-pentahydroxy-11,21-dimethyl-10,20-dioxapentacyclo[10.7.2.0²,¹¹.0³,⁸.0¹³,¹⁹]henicosa-3(8),4,6,13(19),14,16-hexaen-18-one

6,7,16,17,21-pentahydroxy-11,21-dimethyl-10,20-dioxapentacyclo[10.7.2.0²,¹¹.0³,⁸.0¹³,¹⁹]henicosa-3(8),4,6,13(19),14,16-hexaen-18-one

C21H20O8 (400.1158)


   

3-[(2-carboxyphenyl)amino]-2-(2,3,4-trihydroxybutyl)-1h-indole-7-carboxylic acid

3-[(2-carboxyphenyl)amino]-2-(2,3,4-trihydroxybutyl)-1h-indole-7-carboxylic acid

C20H20N2O7 (400.127)


   

4-oxo-3-(1,3,6,8-tetrahydroxy-9,10-dioxoanthracen-2-yl)butyl acetate

4-oxo-3-(1,3,6,8-tetrahydroxy-9,10-dioxoanthracen-2-yl)butyl acetate

C20H16O9 (400.0794)


   

11-chloro-12,13-dihydroxy-5-(1-hydroxyethyl)-10,14-dimethyl-3,6,16-trioxapentacyclo[8.6.1.0²,⁴.0⁴,⁹.0¹⁴,¹⁷]heptadec-8-ene-7,15-dione

11-chloro-12,13-dihydroxy-5-(1-hydroxyethyl)-10,14-dimethyl-3,6,16-trioxapentacyclo[8.6.1.0²,⁴.0⁴,⁹.0¹⁴,¹⁷]heptadec-8-ene-7,15-dione

C18H21ClO8 (400.0925)


   

(2s,3r,4s,5r,6s)-3,4,5-trihydroxy-6-{[(2s,3s,4s,5s,6r,7r)-2,4,5,6,7-pentahydroxy-1-oxooctan-3-yl]oxy}oxane-2-carboxylic acid

(2s,3r,4s,5r,6s)-3,4,5-trihydroxy-6-{[(2s,3s,4s,5s,6r,7r)-2,4,5,6,7-pentahydroxy-1-oxooctan-3-yl]oxy}oxane-2-carboxylic acid

C14H24O13 (400.1217)


   

(3r)-13-chloro-5,8,9,14,16-pentahydroxy-3-methyl-4,5,8,9,10,12-hexahydro-3h-2-benzoxacyclotetradecine-1,11-dione

(3r)-13-chloro-5,8,9,14,16-pentahydroxy-3-methyl-4,5,8,9,10,12-hexahydro-3h-2-benzoxacyclotetradecine-1,11-dione

C18H21ClO8 (400.0925)


   

6-(1,2-dihydroxyethyl)-2,5-dihydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxane-2-carboxylic acid

6-(1,2-dihydroxyethyl)-2,5-dihydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxane-2-carboxylic acid

C14H24O13 (400.1217)


   

5,7-dihydroxy-2-phenyl-6-[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]chromen-4-one

5,7-dihydroxy-2-phenyl-6-[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]chromen-4-one

C21H20O8 (400.1158)


   

(2r)-1-hydroxy-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

(2r)-1-hydroxy-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

C18H24O10 (400.1369)


   

[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-{[(2r)-1-hydroxypropan-2-yl]oxy}oxan-2-yl]methyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-{[(2r)-1-hydroxypropan-2-yl]oxy}oxan-2-yl]methyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

C18H24O10 (400.1369)


   

methyl (3s)-4-(2-hydroxy-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-3-methyl-4-oxobutanoate

methyl (3s)-4-(2-hydroxy-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-3-methyl-4-oxobutanoate

C18H24O10 (400.1369)


   

(2s,3s,4r,6s,8r)-4-chloro-3-ethenyl-9-hydroxy-2-isothiocyanato-3,7,7-trimethyl-10-azatetracyclo[6.6.1.1²,⁶.0¹¹,¹⁵]hexadeca-1(14),9,11(15),12-tetraen-16-one

(2s,3s,4r,6s,8r)-4-chloro-3-ethenyl-9-hydroxy-2-isothiocyanato-3,7,7-trimethyl-10-azatetracyclo[6.6.1.1²,⁶.0¹¹,¹⁵]hexadeca-1(14),9,11(15),12-tetraen-16-one

C21H21ClN2O2S (400.1012)


   

(1r,2e,4r,5s,6s)-6-(acetyloxy)-1-[(2s,3s)-3-(acetyloxy)-6-oxo-2,3-dihydropyran-2-yl]-1,5-dihydroxyhept-2-en-4-yl acetate

(1r,2e,4r,5s,6s)-6-(acetyloxy)-1-[(2s,3s)-3-(acetyloxy)-6-oxo-2,3-dihydropyran-2-yl]-1,5-dihydroxyhept-2-en-4-yl acetate

C18H24O10 (400.1369)


   

3-(4-hydroxyphenyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one

3-(4-hydroxyphenyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one

C21H20O8 (400.1158)


   

(10s)-5-hydroxy-2-(4-hydroxyphenyl)-10-phenyl-9h,10h-pyrano[2,3-h]chromene-4,8-dione

(10s)-5-hydroxy-2-(4-hydroxyphenyl)-10-phenyl-9h,10h-pyrano[2,3-h]chromene-4,8-dione

C24H16O6 (400.0947)


   

methyl 4-(2-hydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-3-methyl-4-oxobutanoate

methyl 4-(2-hydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-3-methyl-4-oxobutanoate

C18H24O10 (400.1369)


   

(2s,3r,4s,5s,6r)-2-{[(1r,3r,4ar,6r,7s,7as)-3-chloro-6,7-dihydroxy-7-(hydroxymethyl)-hexahydro-1h-cyclopenta[c]pyran-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

(2s,3r,4s,5s,6r)-2-{[(1r,3r,4ar,6r,7s,7as)-3-chloro-6,7-dihydroxy-7-(hydroxymethyl)-hexahydro-1h-cyclopenta[c]pyran-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C15H25ClO10 (400.1136)


   

[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-{[(2s)-1-hydroxypropan-2-yl]oxy}oxan-2-yl]methyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-{[(2s)-1-hydroxypropan-2-yl]oxy}oxan-2-yl]methyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

C18H24O10 (400.1369)


   

(3s,5s,7z,9e)-6,13-dichloro-5,14,16-trihydroxy-3-methyl-4,5,6,12-tetrahydro-3h-2-benzoxacyclotetradecine-1,11-dione

(3s,5s,7z,9e)-6,13-dichloro-5,14,16-trihydroxy-3-methyl-4,5,6,12-tetrahydro-3h-2-benzoxacyclotetradecine-1,11-dione

C18H18Cl2O6 (400.048)


   

15-hydroxy-1,11-bis(methylsulfanyl)-3,13-diazapentacyclo[11.7.0.0³,¹¹.0⁴,⁹.0¹⁴,¹⁹]icosa-4,6,8,16,18-pentaene-2,12-dione

15-hydroxy-1,11-bis(methylsulfanyl)-3,13-diazapentacyclo[11.7.0.0³,¹¹.0⁴,⁹.0¹⁴,¹⁹]icosa-4,6,8,16,18-pentaene-2,12-dione

C20H20N2O3S2 (400.0915)


   

(1r,2r,3s,4s,5s,6s)-6-[(benzoyloxy)methyl]-2,4,5-trihydroxy-7-oxabicyclo[4.1.0]heptan-3-yl benzoate

(1r,2r,3s,4s,5s,6s)-6-[(benzoyloxy)methyl]-2,4,5-trihydroxy-7-oxabicyclo[4.1.0]heptan-3-yl benzoate

C21H20O8 (400.1158)


   

5,7-dihydroxy-3-[4-hydroxy-2-(2-hydroxypropan-2-yl)-5-methoxy-2,3-dihydro-1-benzofuran-7-yl]chromen-4-one

5,7-dihydroxy-3-[4-hydroxy-2-(2-hydroxypropan-2-yl)-5-methoxy-2,3-dihydro-1-benzofuran-7-yl]chromen-4-one

C21H20O8 (400.1158)


   

3-[(3s)-3,5-dihydroxy-8-methoxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-6-yl]-5,7-dihydroxychromen-4-one

3-[(3s)-3,5-dihydroxy-8-methoxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-6-yl]-5,7-dihydroxychromen-4-one

C21H20O8 (400.1158)


   

8a-hydroxy-7-methyl-6,8-dioxo-3-(prop-1-en-1-yl)-1h-isochromen-7-yl 2,4-dihydroxy-6-methylbenzoate

8a-hydroxy-7-methyl-6,8-dioxo-3-(prop-1-en-1-yl)-1h-isochromen-7-yl 2,4-dihydroxy-6-methylbenzoate

C21H20O8 (400.1158)


   

(2e,6s)-6-(acetyloxy)-1-[(2s,3s)-3-(acetyloxy)-6-oxo-2,3-dihydropyran-2-yl]-1,5-dihydroxyhept-2-en-4-yl acetate

(2e,6s)-6-(acetyloxy)-1-[(2s,3s)-3-(acetyloxy)-6-oxo-2,3-dihydropyran-2-yl]-1,5-dihydroxyhept-2-en-4-yl acetate

C18H24O10 (400.1369)


   

5,7-dihydroxy-6-methyl-4-phenyl-8-(3-phenylpropanoyl)chromen-2-one

5,7-dihydroxy-6-methyl-4-phenyl-8-(3-phenylpropanoyl)chromen-2-one

C25H20O5 (400.1311)


   

(1r,15s,23s)-6-hydroxy-9,11-dimethoxy-22-oxahexacyclo[10.10.2.0²,⁷.0⁸,²⁴.0¹⁵,²³.0¹⁶,²¹]tetracosa-2,4,6,8,10,12(24),16,18,20-nonaen-13-one

(1r,15s,23s)-6-hydroxy-9,11-dimethoxy-22-oxahexacyclo[10.10.2.0²,⁷.0⁸,²⁴.0¹⁵,²³.0¹⁶,²¹]tetracosa-2,4,6,8,10,12(24),16,18,20-nonaen-13-one

C25H20O5 (400.1311)


   

versiconal acetate

versiconal acetate

C20H16O9 (400.0794)


   

3-[(3s)-3,5-dihydroxy-6-methoxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-8-yl]-5,7-dihydroxychromen-4-one

3-[(3s)-3,5-dihydroxy-6-methoxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-8-yl]-5,7-dihydroxychromen-4-one

C21H20O8 (400.1158)


   

(2s)-2-hydroxy-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

(2s)-2-hydroxy-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

C18H24O10 (400.1369)


   

3-(3,5-dihydroxy-8-methoxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-6-yl)-5,7-dihydroxychromen-4-one

3-(3,5-dihydroxy-8-methoxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-6-yl)-5,7-dihydroxychromen-4-one

C21H20O8 (400.1158)


   

methyl 2-[2-(2-hydroxy-6-methylphenyl)-1,3-benzoxazol-4-yl]-1,3-benzoxazole-4-carboxylate

methyl 2-[2-(2-hydroxy-6-methylphenyl)-1,3-benzoxazol-4-yl]-1,3-benzoxazole-4-carboxylate

C23H16N2O5 (400.1059)


   

5-[2,3-dihydroxy-2-methyl-4-({7-oxofuro[3,2-g]chromen-9-yl}oxy)butyl]-3-methyl-5h-furan-2-one

5-[2,3-dihydroxy-2-methyl-4-({7-oxofuro[3,2-g]chromen-9-yl}oxy)butyl]-3-methyl-5h-furan-2-one

C21H20O8 (400.1158)


   

(1s,3as,4s,6ar)-1,4-bis(2h-1,3-benzodioxol-5-yl)-4-methoxy-tetrahydrofuro[3,4-c]furan-3a-ol

(1s,3as,4s,6ar)-1,4-bis(2h-1,3-benzodioxol-5-yl)-4-methoxy-tetrahydrofuro[3,4-c]furan-3a-ol

C21H20O8 (400.1158)


   

5-hydroxy-2-(4-hydroxyphenyl)-10-phenyl-9h,10h-pyrano[2,3-h]chromene-4,8-dione

5-hydroxy-2-(4-hydroxyphenyl)-10-phenyl-9h,10h-pyrano[2,3-h]chromene-4,8-dione

C24H16O6 (400.0947)


   

(2s,3s,4r,6r,8r)-4-chloro-3-ethenyl-9-hydroxy-2-isothiocyanato-3,7,7-trimethyl-10-azatetracyclo[6.6.1.1²,⁶.0¹¹,¹⁵]hexadeca-1(14),9,11(15),12-tetraen-16-one

(2s,3s,4r,6r,8r)-4-chloro-3-ethenyl-9-hydroxy-2-isothiocyanato-3,7,7-trimethyl-10-azatetracyclo[6.6.1.1²,⁶.0¹¹,¹⁵]hexadeca-1(14),9,11(15),12-tetraen-16-one

C21H21ClN2O2S (400.1012)


   

(2r,3r)-3-(3,4-dimethoxyphenyl)-2-(hydroxymethyl)-5-methoxy-2h,3h-[1,4]dioxino[2,3-h]chromen-9-one

(2r,3r)-3-(3,4-dimethoxyphenyl)-2-(hydroxymethyl)-5-methoxy-2h,3h-[1,4]dioxino[2,3-h]chromen-9-one

C21H20O8 (400.1158)


   

[2-(2h-1,3-benzodioxol-5-yl)-4-(4-methoxy-2h-1,3-benzodioxole-5-carbonyl)oxolan-3-yl]methanol

[2-(2h-1,3-benzodioxol-5-yl)-4-(4-methoxy-2h-1,3-benzodioxole-5-carbonyl)oxolan-3-yl]methanol

C21H20O8 (400.1158)


   

methyl 4-(3,5-diformyl-4-hydroxy-2-methylbenzoyloxy)-2-hydroxy-3,5,6-trimethylbenzoate

methyl 4-(3,5-diformyl-4-hydroxy-2-methylbenzoyloxy)-2-hydroxy-3,5,6-trimethylbenzoate

C21H20O8 (400.1158)


   

(2s)-2-hydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

(2s)-2-hydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

C18H24O10 (400.1369)


   

(10r,11s,15r,16r)-16-hydroxy-10-(4-hydroxy-3,5-dimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one

(10r,11s,15r,16r)-16-hydroxy-10-(4-hydroxy-3,5-dimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one

C21H20O8 (400.1158)


   

(2s)-1-[4-(acetyloxy)-2-hydroxyphenyl]-3-[4-(acetyloxy)phenyl]-1-oxopropan-2-yl acetate

(2s)-1-[4-(acetyloxy)-2-hydroxyphenyl]-3-[4-(acetyloxy)phenyl]-1-oxopropan-2-yl acetate

C21H20O8 (400.1158)


   

2,4-dihydroxy-5-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}-3-methoxyhexanedioic acid

2,4-dihydroxy-5-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}-3-methoxyhexanedioic acid

C17H20O11 (400.1006)


   

3,4,5-trihydroxy-6-[(2,4,5,6,7-pentahydroxy-1-oxooctan-3-yl)oxy]oxane-2-carboxylic acid

3,4,5-trihydroxy-6-[(2,4,5,6,7-pentahydroxy-1-oxooctan-3-yl)oxy]oxane-2-carboxylic acid

C14H24O13 (400.1217)


   

3-{2,4-dihydroxy-3-[(2z)-4-hydroxy-3-methylbut-2-en-1-yl]-5-methoxyphenyl}-5,7-dihydroxychromen-4-one

3-{2,4-dihydroxy-3-[(2z)-4-hydroxy-3-methylbut-2-en-1-yl]-5-methoxyphenyl}-5,7-dihydroxychromen-4-one

C21H20O8 (400.1158)


   

3-(3,8-dihydroxy-7-methoxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-5-yl)-5,7-dihydroxychromen-4-one

3-(3,8-dihydroxy-7-methoxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-5-yl)-5,7-dihydroxychromen-4-one

C21H20O8 (400.1158)


   

5,5'-dimethyl (5s,5's)-5,5'-dihydroxy-4,4'-dimethoxy-1,1'-dimethyl-2,2'-dioxo-[3,3'-bipyrrole]-5,5'-dicarboxylate

5,5'-dimethyl (5s,5's)-5,5'-dihydroxy-4,4'-dimethoxy-1,1'-dimethyl-2,2'-dioxo-[3,3'-bipyrrole]-5,5'-dicarboxylate

C16H20N2O10 (400.1118)


   

(2s)-2-hydroxy-2-[(2r)-10-hydroxy-5-methoxy-6-oxo-1h,2h-furo[2,3-c]xanthen-2-yl]propyl acetate

(2s)-2-hydroxy-2-[(2r)-10-hydroxy-5-methoxy-6-oxo-1h,2h-furo[2,3-c]xanthen-2-yl]propyl acetate

C21H20O8 (400.1158)


   

methyl (3r)-4-(2-hydroxy-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-3-methyl-4-oxobutanoate

methyl (3r)-4-(2-hydroxy-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-3-methyl-4-oxobutanoate

C18H24O10 (400.1369)


   

(17s)-13-hydroxy-5,17-dimethoxy-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-carbaldehyde

(17s)-13-hydroxy-5,17-dimethoxy-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-carbaldehyde

C20H16O9 (400.0794)


   

[(2s,3r,4s)-2-(2h-1,3-benzodioxol-5-yl)-4-(4-methoxy-2h-1,3-benzodioxole-5-carbonyl)oxolan-3-yl]methanol

[(2s,3r,4s)-2-(2h-1,3-benzodioxol-5-yl)-4-(4-methoxy-2h-1,3-benzodioxole-5-carbonyl)oxolan-3-yl]methanol

C21H20O8 (400.1158)


   

[(1s)-8-hydroxy-1-methyl-12-oxo-14-oxapentacyclo[11.6.1.0²,¹¹.0⁴,⁹.0¹⁶,²⁰]icosa-2,4,6,8,10,13(20),15-heptaen-5-yl]oxidanesulfonic acid

[(1s)-8-hydroxy-1-methyl-12-oxo-14-oxapentacyclo[11.6.1.0²,¹¹.0⁴,⁹.0¹⁶,²⁰]icosa-2,4,6,8,10,13(20),15-heptaen-5-yl]oxidanesulfonic acid

C20H16O7S (400.0617)


   

(2s,3s,4s,5r)-2,4-dihydroxy-5-{[(2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}-3-methoxyhexanedioic acid

(2s,3s,4s,5r)-2,4-dihydroxy-5-{[(2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}-3-methoxyhexanedioic acid

C17H20O11 (400.1006)


   

7-hydroxy-3-(3-hydroxyprop-1-en-1-yl)-7-methyl-6-oxo-8h-isochromen-8-yl 2,4-dihydroxy-6-methylbenzoate

7-hydroxy-3-(3-hydroxyprop-1-en-1-yl)-7-methyl-6-oxo-8h-isochromen-8-yl 2,4-dihydroxy-6-methylbenzoate

C21H20O8 (400.1158)


   

2-(3,4-dihydroxyphenyl)-8-hydroxy-11-methoxynaphtho[2,1-f]chromen-9-one

2-(3,4-dihydroxyphenyl)-8-hydroxy-11-methoxynaphtho[2,1-f]chromen-9-one

C24H16O6 (400.0947)


   

13-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-5,7,9(16),10(15),11,13-hexaen-2-one

13-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-5,7,9(16),10(15),11,13-hexaen-2-one

C20H20N2O7 (400.127)


   

2-[2-(3,5-dihydroxyphenyl)ethenyl]-5-hydroxy-6,7,8-trimethoxy-3-methylchromen-4-one

2-[2-(3,5-dihydroxyphenyl)ethenyl]-5-hydroxy-6,7,8-trimethoxy-3-methylchromen-4-one

C21H20O8 (400.1158)


   

(1e,6e)-4-(1,2-dihydroxyethyl)-1-(3,4-dihydroxyphenyl)-4-hydroxy-7-(4-hydroxyphenyl)hepta-1,6-diene-3,5-dione

(1e,6e)-4-(1,2-dihydroxyethyl)-1-(3,4-dihydroxyphenyl)-4-hydroxy-7-(4-hydroxyphenyl)hepta-1,6-diene-3,5-dione

C21H20O8 (400.1158)


   

(3ar,4s,6ar,8s,9s,9as,9bs)-9-(chloromethyl)-8,9-dihydroxy-3,6-dimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl (2s)-3-hydroxy-2-methylpropanoate

(3ar,4s,6ar,8s,9s,9as,9bs)-9-(chloromethyl)-8,9-dihydroxy-3,6-dimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl (2s)-3-hydroxy-2-methylpropanoate

C19H25ClO7 (400.1289)


   

3-(4-hydroxyphenyl)-8-[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one

3-(4-hydroxyphenyl)-8-[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one

C21H20O8 (400.1158)


   

2-hydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl 3-(4-hydroxyphenyl)prop-2-enoate

2-hydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl 3-(4-hydroxyphenyl)prop-2-enoate

C18H24O10 (400.1369)


   

(3s)-3,5,7-trihydroxy-3-[(2r)-2-(hydroxymethyl)-5-methoxy-2-methylchromen-6-yl]-2h-1-benzopyran-4-one

(3s)-3,5,7-trihydroxy-3-[(2r)-2-(hydroxymethyl)-5-methoxy-2-methylchromen-6-yl]-2h-1-benzopyran-4-one

C21H20O8 (400.1158)


   

7,8-bis(acetyloxy)-3-methoxy-9-oxoxanthen-1-yl acetate

7,8-bis(acetyloxy)-3-methoxy-9-oxoxanthen-1-yl acetate

C20H16O9 (400.0794)


   

7-hydroxy-7-methyl-6-oxo-3-(3-oxoprop-1-en-1-yl)-8,8a-dihydro-1h-isochromen-8-yl 2,4-dihydroxy-6-methylbenzoate

7-hydroxy-7-methyl-6-oxo-3-(3-oxoprop-1-en-1-yl)-8,8a-dihydro-1h-isochromen-8-yl 2,4-dihydroxy-6-methylbenzoate

C21H20O8 (400.1158)


   

(1r,11r,14s,15s)-15-hydroxy-1,11-bis(methylsulfanyl)-3,13-diazapentacyclo[11.7.0.0³,¹¹.0⁴,⁹.0¹⁴,¹⁹]icosa-4,6,8,16,18-pentaene-2,12-dione

(1r,11r,14s,15s)-15-hydroxy-1,11-bis(methylsulfanyl)-3,13-diazapentacyclo[11.7.0.0³,¹¹.0⁴,⁹.0¹⁴,¹⁹]icosa-4,6,8,16,18-pentaene-2,12-dione

C20H20N2O3S2 (400.0915)


   

5,5'-dimethyl 5,5'-dihydroxy-4,4'-dimethoxy-1,1'-dimethyl-2,2'-dioxo-[3,3'-bipyrrole]-5,5'-dicarboxylate

5,5'-dimethyl 5,5'-dihydroxy-4,4'-dimethoxy-1,1'-dimethyl-2,2'-dioxo-[3,3'-bipyrrole]-5,5'-dicarboxylate

C16H20N2O10 (400.1118)


   

{3,4,5-trihydroxy-6-[(1-hydroxypropan-2-yl)oxy]oxan-2-yl}methyl 3-(3,4-dihydroxyphenyl)prop-2-enoate

{3,4,5-trihydroxy-6-[(1-hydroxypropan-2-yl)oxy]oxan-2-yl}methyl 3-(3,4-dihydroxyphenyl)prop-2-enoate

C18H24O10 (400.1369)


   

3-[(2-carboxyphenyl)amino]-2-[(2s,3r)-2,3,4-trihydroxybutyl]-1h-indole-7-carboxylic acid

3-[(2-carboxyphenyl)amino]-2-[(2s,3r)-2,3,4-trihydroxybutyl]-1h-indole-7-carboxylic acid

C20H20N2O7 (400.127)


   

6-hydroxy-4-(4-hydroxy-3,5-dimethoxyphenyl)-5,7-dimethoxynaphthalene-2-carboxylic acid

6-hydroxy-4-(4-hydroxy-3,5-dimethoxyphenyl)-5,7-dimethoxynaphthalene-2-carboxylic acid

C21H20O8 (400.1158)


   

2,3,4,5-tetrahydroxy-8-[(2r,3r)-3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl]benzo[7]annulen-6-one

2,3,4,5-tetrahydroxy-8-[(2r,3r)-3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl]benzo[7]annulen-6-one

C20H16O9 (400.0794)


   

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

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

C20H16O9 (400.0794)


   

(10s)-3,5-dihydroxy-2,10-diphenyl-9h,10h-pyrano[2,3-h]chromene-4,8-dione

(10s)-3,5-dihydroxy-2,10-diphenyl-9h,10h-pyrano[2,3-h]chromene-4,8-dione

C24H16O6 (400.0947)


   

(7s,8s)-7-hydroxy-3-[(1e)-3-hydroxyprop-1-en-1-yl]-7-methyl-6-oxo-8h-isochromen-8-yl 2,4-dihydroxy-6-methylbenzoate

(7s,8s)-7-hydroxy-3-[(1e)-3-hydroxyprop-1-en-1-yl]-7-methyl-6-oxo-8h-isochromen-8-yl 2,4-dihydroxy-6-methylbenzoate

C21H20O8 (400.1158)


   

(2r)-2-hydroxy-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

(2r)-2-hydroxy-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

C18H24O10 (400.1369)


   

6,13-dichloro-5,14,16-trihydroxy-3-methyl-4,5,6,12-tetrahydro-3h-2-benzoxacyclotetradecine-1,11-dione

6,13-dichloro-5,14,16-trihydroxy-3-methyl-4,5,6,12-tetrahydro-3h-2-benzoxacyclotetradecine-1,11-dione

C18H18Cl2O6 (400.048)


   

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

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

C21H20O8 (400.1158)


   

(7s,8s,8as)-7-hydroxy-7-methyl-6-oxo-3-[(1e)-3-oxoprop-1-en-1-yl]-8,8a-dihydro-1h-isochromen-8-yl 2,4-dihydroxy-6-methylbenzoate

(7s,8s,8as)-7-hydroxy-7-methyl-6-oxo-3-[(1e)-3-oxoprop-1-en-1-yl]-8,8a-dihydro-1h-isochromen-8-yl 2,4-dihydroxy-6-methylbenzoate

C21H20O8 (400.1158)


   

methyl 2-(6,8-dihydroxy-3-methyl-1-oxoisochromene-7-carbonyl)-3-hydroxy-5-methoxybenzoate

methyl 2-(6,8-dihydroxy-3-methyl-1-oxoisochromene-7-carbonyl)-3-hydroxy-5-methoxybenzoate

C20H16O9 (400.0794)


   

2-(acetyloxy)-7-[3-(acetyloxy)-6-oxo-2,3-dihydropyran-2-yl]-6,7-dihydroxyhept-4-en-3-yl acetate

2-(acetyloxy)-7-[3-(acetyloxy)-6-oxo-2,3-dihydropyran-2-yl]-6,7-dihydroxyhept-4-en-3-yl acetate

C18H24O10 (400.1369)


   

3-[5,6-dihydroxy-2-(methoxycarbonyl)-1-benzofuran-3-yl]-5,6-dihydroxy-1-benzofuran-2-carboxylic acid

3-[5,6-dihydroxy-2-(methoxycarbonyl)-1-benzofuran-3-yl]-5,6-dihydroxy-1-benzofuran-2-carboxylic acid

C19H12O10 (400.043)


   

2-hydroxy-2-{10-hydroxy-5-methoxy-6-oxo-1h,2h-furo[2,3-c]xanthen-2-yl}propyl acetate

2-hydroxy-2-{10-hydroxy-5-methoxy-6-oxo-1h,2h-furo[2,3-c]xanthen-2-yl}propyl acetate

C21H20O8 (400.1158)


   

(1s,2e,4s,5s,6s)-6-(acetyloxy)-1-[(2s,3s)-3-(acetyloxy)-6-oxo-2,3-dihydropyran-2-yl]-1,5-dihydroxyhept-2-en-4-yl acetate

(1s,2e,4s,5s,6s)-6-(acetyloxy)-1-[(2s,3s)-3-(acetyloxy)-6-oxo-2,3-dihydropyran-2-yl]-1,5-dihydroxyhept-2-en-4-yl acetate

C18H24O10 (400.1369)


   

2-{[3,4-bis(acetyloxy)-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-hydroxybenzoic acid

2-{[3,4-bis(acetyloxy)-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-hydroxybenzoic acid

C17H20O11 (400.1006)


   

(1r,10r)-5,7,10,14-tetrahydroxy-12-methoxy-15-(3-methylbut-2-en-1-yl)-2,17-dioxatetracyclo[8.7.0.0³,⁸.0¹¹,¹⁶]heptadeca-3,5,7,11(16),12,14-hexaen-9-one

(1r,10r)-5,7,10,14-tetrahydroxy-12-methoxy-15-(3-methylbut-2-en-1-yl)-2,17-dioxatetracyclo[8.7.0.0³,⁸.0¹¹,¹⁶]heptadeca-3,5,7,11(16),12,14-hexaen-9-one

C21H20O8 (400.1158)


   

(2s,3r)-5,7-dihydroxy-2-(4-hydroxyphenyl)-8-methoxy-4-oxo-2,3-dihydro-1-benzopyran-3-yl (2z)-2-methylbut-2-enoate

(2s,3r)-5,7-dihydroxy-2-(4-hydroxyphenyl)-8-methoxy-4-oxo-2,3-dihydro-1-benzopyran-3-yl (2z)-2-methylbut-2-enoate

C21H20O8 (400.1158)


   

4-chloro-3-ethenyl-9-hydroxy-2-isothiocyanato-3,7,7-trimethyl-10-azatetracyclo[6.6.1.1²,⁶.0¹¹,¹⁵]hexadeca-1(14),9,11(15),12-tetraen-16-one

4-chloro-3-ethenyl-9-hydroxy-2-isothiocyanato-3,7,7-trimethyl-10-azatetracyclo[6.6.1.1²,⁶.0¹¹,¹⁵]hexadeca-1(14),9,11(15),12-tetraen-16-one

C21H21ClN2O2S (400.1012)


   

3-[(3r)-3,5-dihydroxy-8-methoxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-6-yl]-5,7-dihydroxychromen-4-one

3-[(3r)-3,5-dihydroxy-8-methoxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-6-yl]-5,7-dihydroxychromen-4-one

C21H20O8 (400.1158)


   

1-hydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl 3-(4-hydroxyphenyl)prop-2-enoate

1-hydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl 3-(4-hydroxyphenyl)prop-2-enoate

C18H24O10 (400.1369)


   

13-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-5,7,9(16),10(15),11,13-hexaen-2-one

13-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-5,7,9(16),10(15),11,13-hexaen-2-one

C20H20N2O7 (400.127)


   

(3r,5r,6s,7z,9e)-6,13-dichloro-5,14,16-trihydroxy-3-methyl-4,5,6,12-tetrahydro-3h-2-benzoxacyclotetradecine-1,11-dione

(3r,5r,6s,7z,9e)-6,13-dichloro-5,14,16-trihydroxy-3-methyl-4,5,6,12-tetrahydro-3h-2-benzoxacyclotetradecine-1,11-dione

C18H18Cl2O6 (400.048)


   

5,7-dihydroxy-2-phenyl-6-(3,4,5-trihydroxy-6-methyloxan-2-yl)chromen-4-one

5,7-dihydroxy-2-phenyl-6-(3,4,5-trihydroxy-6-methyloxan-2-yl)chromen-4-one

C21H20O8 (400.1158)


   

1-[4-(acetyloxy)-2-hydroxyphenyl]-3-[4-(acetyloxy)phenyl]-1-oxopropan-2-yl acetate

1-[4-(acetyloxy)-2-hydroxyphenyl]-3-[4-(acetyloxy)phenyl]-1-oxopropan-2-yl acetate

C21H20O8 (400.1158)


   

(1s,2r,4s,5r,10s,11r,12r,13r,14r,17s)-11-chloro-12,13-dihydroxy-5-[(1r)-1-hydroxyethyl]-10,14-dimethyl-3,6,16-trioxapentacyclo[8.6.1.0²,⁴.0⁴,⁹.0¹⁴,¹⁷]heptadec-8-ene-7,15-dione

(1s,2r,4s,5r,10s,11r,12r,13r,14r,17s)-11-chloro-12,13-dihydroxy-5-[(1r)-1-hydroxyethyl]-10,14-dimethyl-3,6,16-trioxapentacyclo[8.6.1.0²,⁴.0⁴,⁹.0¹⁴,¹⁷]heptadec-8-ene-7,15-dione

C18H21ClO8 (400.0925)


   

2-[(1e)-2-(3,5-dihydroxyphenyl)ethenyl]-5-hydroxy-6,7,8-trimethoxy-3-methylchromen-4-one

2-[(1e)-2-(3,5-dihydroxyphenyl)ethenyl]-5-hydroxy-6,7,8-trimethoxy-3-methylchromen-4-one

C21H20O8 (400.1158)


   

(3s)-3,5,7-trihydroxy-3-[2-(hydroxymethyl)-5-methoxy-2-methylchromen-6-yl]-2h-1-benzopyran-4-one

(3s)-3,5,7-trihydroxy-3-[2-(hydroxymethyl)-5-methoxy-2-methylchromen-6-yl]-2h-1-benzopyran-4-one

C21H20O8 (400.1158)


   

(2r,3r)-3-(4-hydroxy-3,5-dimethoxyphenyl)-5-methoxy-2-methyl-2h,3h-[1,4]dioxino[2,3-h]chromen-9-one

(2r,3r)-3-(4-hydroxy-3,5-dimethoxyphenyl)-5-methoxy-2-methyl-2h,3h-[1,4]dioxino[2,3-h]chromen-9-one

C21H20O8 (400.1158)


   

5,7-dihydroxy-3-[(2r)-4-hydroxy-2-(2-hydroxypropan-2-yl)-5-methoxy-2,3-dihydro-1-benzofuran-7-yl]chromen-4-one

5,7-dihydroxy-3-[(2r)-4-hydroxy-2-(2-hydroxypropan-2-yl)-5-methoxy-2,3-dihydro-1-benzofuran-7-yl]chromen-4-one

C21H20O8 (400.1158)


   

3-methyl-n-(2-{4-thia-6,9,19-triazapentacyclo[10.7.1.0³,⁷.0⁸,²⁰.0¹³,¹⁸]icosa-1,3(7),5,8(20),9,11,13,15,17-nonaen-2-yl}ethyl)but-2-enimidic acid

3-methyl-n-(2-{4-thia-6,9,19-triazapentacyclo[10.7.1.0³,⁷.0⁸,²⁰.0¹³,¹⁸]icosa-1,3(7),5,8(20),9,11,13,15,17-nonaen-2-yl}ethyl)but-2-enimidic acid

C23H20N4OS (400.1358)