Exact Mass: 428.1659886
Exact Mass Matches: 428.1659886
Found 500 metabolites which its exact mass value is equals to given mass value 428.1659886,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Wortmannin
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists > D007329 - Insulin Antagonists C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C2152 - Phosphatidylinositide 3-Kinase Inhibitor D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D004791 - Enzyme Inhibitors > D047428 - Protein Kinase Inhibitors D000890 - Anti-Infective Agents > D000935 - Antifungal Agents C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor D011838 - Radiation-Sensitizing Agents
Furcatin
C20H28O10 (428.16823880000004)
A disaccharide derivative that is beta-D-apiofuranosyl-(1->6)-D-glucopyranose with a 4-(prop-2-en-1-yl)phenyl group substituent.
1-Hydroxy-13-O-acetyl-N-methylcanadine
C23H26NO7+ (428.17091860000005)
Garcinone D
Garcinone D is a natural product found in Garcinia morella, Garcinia dulcis, and other organisms with data available. From Garcinia mangostana (mangosteen). Garcinone D is found in fruits and purple mangosteen. Garcinone D is found in fruits. Garcinone D is from Garcinia mangostana (mangosteen).
3'-(1'-(3-Methylbutanoyl))-angeloyl vaginidiol
3-(1-(3-Methylbutanoyl))-angeloyl vaginidiol is found in fats and oils. 3-(1-(3-Methylbutanoyl))-angeloyl vaginidiol is a constituent of the roots of Angelica archangelica (angelica). Constituent of the roots of Angelica archangelica (angelica). 3-(1-(3-Methylbutanoyl))-angeloyl vaginidiol is found in fats and oils, herbs and spices, and green vegetables.
Ptelatoside B
C20H28O10 (428.16823880000004)
Constituent of Pteridium aquilinum (bracken fern). Ptelatoside B is found in green vegetables and root vegetables. Ptelatoside B is found in green vegetables. Ptelatoside B is a constituent of Pteridium aquilinum (bracken fern)
3-Isomangostin hydrate
3-Isomangostin hydrate is found in fruits. 3-Isomangostin hydrate is a constituent of Garcinia mangostana (mangosteen). Constituent of Garcinia mangostana (mangosteen). 3-Isomangostin hydrate is found in fruits.
Artoflavanone
Artoflavanone is found in fruits. Artoflavanone is a constituent of Artocarpus heterophyllus (jackfruit)
Heteroflavanone B
Heteroflavanone B is found in fruits. Heteroflavanone B is a constituent of the root bark of Artocarpus heterophyllus (jackfruit). Constituent of the root bark of Artocarpus heterophyllus (jackfruit). Heteroflavanone B is found in jackfruit and fruits.
Edulisin V
Edulisin V is found in green vegetables. Edulisin V is a constituent of Angelica edulis. Constituent of Angelica edulis. Edulisin V is found in green vegetables.
1-Isomangostin hydrate
1-Isomangostin hydrate is found in fruits. 1-Isomangostin hydrate is a constituent of Garcinia mangostana (mangosteen)
b-D-Xylopyranosyl-(1->4)-a-L-rhamnopyranosyl-(1->2)-L-arabinose
b-D-Xylopyranosyl-(1->4)-a-L-rhamnopyranosyl-(1->2)-L-arabinose is found in fruits. b-D-Xylopyranosyl-(1->4)-a-L-rhamnopyranosyl-(1->2)-L-arabinose is a constituent of Acutosides from Luffa acutangula (Chinese okra). Constituent of Acutosides from Luffa acutangula (Chinese okra). b-D-Xylopyranosyl-(1->4)-a-L-rhamnopyranosyl-(1->2)-L-arabinose is found in fruits.
Capivasertib
C21H25ClN6O2 (428.17274199999997)
Miricorilant
C274 - Antineoplastic Agent > C129818 - Antineoplastic Hormonal/Endocrine Agent > C183052 - Glucocorticoid Receptor Antagonist C147908 - Hormone Therapy Agent
Halobetasol
C22H27ClF2O4 (428.15658360000003)
rosavin
C20H28O10 (428.16823880000004)
wortmannin
trans-p-Ferulyl alcohol 4-O-[6-(2-methyl-3-hydroxypropionyl)] glucopyranoside
C20H28O10 (428.16823880000004)
Trans-p-ferulyl alcohol 4-o-[6-(2-methyl-3-hydroxypropionyl)] glucopyranoside is a member of the class of compounds known as phenolic glycosides. Phenolic glycosides are organic compounds containing a phenolic structure attached to a glycosyl moiety. Some examples of phenolic structures include lignans, and flavonoids. Among the sugar units found in natural glycosides are D-glucose, L-Fructose, and L rhamnose. Trans-p-ferulyl alcohol 4-o-[6-(2-methyl-3-hydroxypropionyl)] glucopyranoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Trans-p-ferulyl alcohol 4-o-[6-(2-methyl-3-hydroxypropionyl)] glucopyranoside can be found in a number of food items such as pepper (c. annuum), red bell pepper, yellow bell pepper, and italian sweet red pepper, which makes trans-p-ferulyl alcohol 4-o-[6-(2-methyl-3-hydroxypropionyl)] glucopyranoside a potential biomarker for the consumption of these food products.
Cratoxylone
Larotrectinib
Rosavin
C20H28O10 (428.16823880000004)
Rosavin is an O-acyl carbohydrate. Rosavin is a natural product found in Rhodiola rosea, Rhodiola crenulata, and other organisms with data available. See also: Sedum roseum root (part of). Rosavin is isolated from R. rosea, Rosavin shows antidepressant-like, adaptogenic, anxiolytic-like effects in mice model[1]. Rosavin is isolated from R. rosea, Rosavin shows antidepressant-like, adaptogenic, anxiolytic-like effects in mice model[1].
Rosarin
C20H28O10 (428.16823880000004)
Rosarin is an O-acyl carbohydrate. Rosarin is a natural product found in Rhodiola rosea, Rhodiola crenulata, and other organisms with data available. See also: Sedum roseum root (part of). Rosarin is a cinnamyl alcohol?glycoside isolated from?Rhodiola rosea. Rosarin has anti-inflammatory and neuroprotective effects. Rosarin supresses the expression of the proinflammatory factors iNOS, IL-1?β, and TNF- α in the kidney and prefrontal cortex of brain in mice?[1]. Rosarin is a cinnamyl alcohol?glycoside isolated from?Rhodiola rosea. Rosarin has anti-inflammatory and neuroprotective effects. Rosarin supresses the expression of the proinflammatory factors iNOS, IL-1?β, and TNF- α in the kidney and prefrontal cortex of brain in mice?[1].
Dehydrocorydaline nitrate
Dehydrocorydaline nitrate (13-Methylpalmatine nitrate) is an alkaloid. Dehydrocorydaline regulates protein expression of Bax, Bcl-2; activates caspase-7, caspase-8, and inactivates PARP[1]. Dehydrocorydaline nitrate elevates p38 MAPK activation. Anti-inflammatory and anti-cancer activities.[2]. Dehydrocorydaline nitrate shows strong anti-malarial effects (IC50?=38 nM), and low cytotoxicity (cell viability?>?90\\%) using P. falciparum 3D7 strain[3]. Dehydrocorydaline nitrate (13-Methylpalmatine nitrate) is an alkaloid. Dehydrocorydaline regulates protein expression of Bax, Bcl-2; activates caspase-7, caspase-8, and inactivates PARP[1]. Dehydrocorydaline nitrate elevates p38 MAPK activation. Anti-inflammatory and anti-cancer activities.[2]. Dehydrocorydaline nitrate shows strong anti-malarial effects (IC50?=38 nM), and low cytotoxicity (cell viability?>?90\%) using P. falciparum 3D7 strain[3].
Praeruptorin E
Praeruptorin E is a natural product found in Musineon divaricatum with data available. Praeruptorin E is a main bioactive constituent of Peucedanum praeruptorum (also known as Bai-Hua Qian Hu). Praeruptorin C is a calcium antagonist with pD2′ value of 5.2[1]. Praeruptorin E is a main bioactive constituent of Peucedanum praeruptorum (also known as Bai-Hua Qian Hu). Praeruptorin C is a calcium antagonist with pD2′ value of 5.2[1].
Cratoxylone
Cratoxylone is a natural product found in Garcinia cowa, Pentadesma butyracea, and other organisms with data available.
Wulongensin A
Praeruptorin C is a natural product found in Musineon divaricatum with data available. Praeruptorin C is a main bioactive constituent of Peucedanum praeruptorum (also known as Bai-Hua Qian Hu). Praeruptorin C is a calcium antagonist with pD2′ value of 5.7[1]. Praeruptorin C is a main bioactive constituent of Peucedanum praeruptorum (also known as Bai-Hua Qian Hu). Praeruptorin C is a calcium antagonist with pD2′ value of 5.7[1].
Praeruptorin
Praeruptorin C is a natural product found in Musineon divaricatum with data available. Praeruptorin C is a main bioactive constituent of Peucedanum praeruptorum (also known as Bai-Hua Qian Hu). Praeruptorin C is a calcium antagonist with pD2′ value of 5.7[1]. Praeruptorin C is a main bioactive constituent of Peucedanum praeruptorum (also known as Bai-Hua Qian Hu). Praeruptorin C is a calcium antagonist with pD2′ value of 5.7[1].
trans-p-Ferulyl alcohol 4-O-[6-(2-methyl-3-hydroxypropionyl)] glucopyranoside
C20H28O10 (428.16823880000004)
3,7-Dihydroxy-3-(2-hydroxy-3-methyl-3-butenyl)-5,6,4-trimethoxyflavone
Brevipolide B
A pyranone that is a carboxylic ester of cis-4-coumaric acid. It is isolated from the whole plant of Hyptis brevipes and has been found to exhibit cytotoxicity against HT-29 and MCF-7 cancer cells.
Derrisin
5,7-Dihydroxy-3-(2-hydroxy-3-methyl-3-butenyl)-3,6,4-trimethoxyflavone
9-(1,1-Dimethyl-2-propenyl)-2,3-dihydro-3,6,7,11-tetrahydroxy-2-(1-hydroxy-1-methylethyl)-5H-furo[3,2-b]xanthen-5-on
(13S,14R)-1-Hydroxy-13-O-acetyl-N-methylcanadine
C23H26NO7+ (428.17091860000005)
2-Phenylethyl 3-O-(4-carboxy-3-hydroxy-3-methylbutanoyl)-β-D-glucopyranoside
C20H28O10 (428.16823880000004)
(2R,3R,4R,5R,6S)-2-[[(2R,3S,4S,5R,6S)-6-(4-ethenylphenoxy)-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol
C20H28O10 (428.16823880000004)
5-O-alpha-D-Glucopyranoside-9-Deazaadenosine
C17H24N4O9 (428.15432139999996)
3,6,8-trihydroxy-1-[(2Z)-7-hydroxy-3,7-dimethyloct-2-en-1-yl]-2-methoxy-9H-xanthen-9-one|butyraxanthone D
1-Butanoyl-2,4,5,7,8-pentamethoxy-anthrachinon|1-Butyryl-2,4,5,7,8-pentamethoxy-anthrachinon
3beta-hydroxy-8alpha-(3,4-dimethoxybenzoyloxy)-11beta,13-dihydro-1alphaH,5alphaH,6betaH,7alphaH-guai-4(15),10(14)-dien-6,12-olide
3,7-Dihydroxy-3-(2-hydroxy-3-methyl-3-butenyl)-4,5,6-trimethoxyflavone
3-[[5,7-dihydroxy-2,2-dimethyl-6-(2-methyl-1-oxopropyl)-2 h -1-benzopyran-8-yl]-methyl]-6-ethyl-4-hydroxy-5-methyl-2 h -pyran-2-one
2-(1-O-feruloyl-2-hydroxyisopropyl)-5,6-dimethoxybenzofuran
5-Deoxy,5-chloro,tri-Ac-8-(1-Hydroxypropyl)-2-(2-penten-4-ynyl)-3,5,6-oxocanetrio
chavicol 4-O-alpha-L-arabinofuranosyl-(1->6)-beta-D-glucopyranoside
C20H28O10 (428.16823880000004)
(-)-1,2-diacetyl-4,5-diangelyl-d (or l)-inositol
C20H28O10 (428.16823880000004)
(+)-cis-(3S,4S)-3,4-diisovalerylkhellactone|peujaponisin
3-[[2,3-dihydro-4,6-dihydroxy-2-(1-methylethenyl)-5-(2-methyl-1-oxopropyl)-7-benzofuranyl]methyl]-6-ethyl-4-hydroxy-5-methyl-2 h -pyran-2-one
benzyl 6-O-[(S)-3-hydroxy-3-methyl-5-methoxyglutaroyl]-beta-D-glucopyranoside|undatuside B
C20H28O10 (428.16823880000004)
phenethyl 6-O-[(S)-3-hydroxy-3-methylglutaroyl]-beta-D-glucopyranoside|undatuside C
C20H28O10 (428.16823880000004)
(-)-(E)-4-hydroxyphenylpropene 4-O-beta-L-xylopyranosyl-(1?6)-beta-D-glucopyranoside
C20H28O10 (428.16823880000004)
(-)-(E)-4-hydroxyphenylpropene 4-O-alpha-L-arabinofuranosyl-(1?6)-beta-D-glucopyranoside
C20H28O10 (428.16823880000004)
(-)-(E)-4-hydroxyphenylpropene 4-O-alpha-L-apiosyl-(1?6)-beta-D-glucopyranoside
C20H28O10 (428.16823880000004)
(-)-(E)-4-hydroxyphenylpropene 4-O-alpha-L-apiosyl-(1?2)-beta-D-glucopyranoside
C20H28O10 (428.16823880000004)
1,3,7,9-tetrahydroxy-2,8-dimethyl-4,6-di(2-methylbutanoyl)-dibenzofuran
3,8-dihydroxy-11-oxo-1-pentanoyl-6-propyl-11H-dibenzo[b,e][1,4]dioxepine-7-carboxylic acid methyl ester|Conloxodin|Couloxodin
3(S)-Angeroyloxy-4(R)-isovaleryloxy-3,4-dihydroxanthyletin (Praeruptorin III)|AD-I
6beta-angeloyloxy-9beta-methacryloyloxy-8-epizinamultifluoride
Tubercidin 5-alpha-D-glucopyranose
C17H24N4O9 (428.15432139999996)
3,4,6-Trimethoxy-3-(2-hydroxy-3-methyl-3-butenyl)-5,7-dihydroxyflavone
9-(1,1-dimethylprop-2-en-1-yl)-3,6,7,11-tetrahydroxy-2-(1-hydroxy-1-methylethyl)-2,3-dihydro-5H-furo[3,2-b]xanthen-5-one
Dehydrocorydaline nitrate
Dehydrocorydaline nitrate (13-Methylpalmatine nitrate) is an alkaloid. Dehydrocorydaline regulates protein expression of Bax, Bcl-2; activates caspase-7, caspase-8, and inactivates PARP[1]. Dehydrocorydaline nitrate elevates p38 MAPK activation. Anti-inflammatory and anti-cancer activities.[2]. Dehydrocorydaline nitrate shows strong anti-malarial effects (IC50?=38 nM), and low cytotoxicity (cell viability?>?90\\%) using P. falciparum 3D7 strain[3]. Dehydrocorydaline nitrate (13-Methylpalmatine nitrate) is an alkaloid. Dehydrocorydaline regulates protein expression of Bax, Bcl-2; activates caspase-7, caspase-8, and inactivates PARP[1]. Dehydrocorydaline nitrate elevates p38 MAPK activation. Anti-inflammatory and anti-cancer activities.[2]. Dehydrocorydaline nitrate shows strong anti-malarial effects (IC50?=38 nM), and low cytotoxicity (cell viability?>?90\%) using P. falciparum 3D7 strain[3].
[8,8-dimethyl-10-(3-methylbut-2-enoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-9-yl] 3-methylbutanoate
9,11,12a-trihydroxy-2,3-dimethoxy-8-(3-methylbut-2-enyl)-6,6a-dihydrochromeno[3,4-b]chromen-12-one
[8-[2-(3-methylbutanoyloxy)propan-2-yl]-2-oxo-8,9-dihydrofuro[2,3-h]chromen-9-yl] (Z)-2-methylbut-2-enoate
C20H28O10_4-Vinylphenyl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside
C20H28O10 (428.16823880000004)
C20H28O10_2-Phenylethyl 3-O-(4-carboxy-3-hydroxy-3-methylbutanoyl)-beta-D-glucopyranoside
C20H28O10 (428.16823880000004)
9,11,12a-trihydroxy-2,3-dimethoxy-8-(3-methylbut-2-enyl)-6,6a-dihydrochromeno[3,4-b]chromen-12-one
[8,8-dimethyl-10-(3-methylbut-2-enoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-9-yl] 3-methylbutanoate
[8-[2-(3-methylbutanoyloxy)propan-2-yl]-2-oxo-8,9-dihydrofuro[2,3-h]chromen-9-yl] (Z)-2-methylbut-2-enoate
(2R,3S,4S,5R,6R)-2-[[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[(E)-3-phenylprop-2-enoxy]oxane-3,4,5-triol
C20H28O10 (428.16823880000004)
5-[(2R,3R,4S,5R,6R)-3,5-dihydroxy-2-(hydroxymethyl)-6-(2-phenylethoxy)oxan-4-yl]oxy-3-hydroxy-3-methyl-5-oxopentanoic acid
C20H28O10 (428.16823880000004)
[8,8-dimethyl-10-(3-methylbut-2-enoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-9-yl] 3-methylbutanoate [IIN-based on: CCMSLIB00000846900]
[8,8-dimethyl-10-(3-methylbut-2-enoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-9-yl] 3-methylbutanoate [IIN-based: Match]
9,11,12a-trihydroxy-2,3-dimethoxy-8-(3-methylbut-2-enyl)-6,6a-dihydrochromeno[3,4-b]chromen-12-one [IIN-based on: CCMSLIB00000847582]
[8,8-dimethyl-10-(3-methylbut-2-enoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-9-yl] 3-methylbutanoate_major
[8,8-dimethyl-10-(3-methylbut-2-enoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-9-yl] 3-methylbutanoate_99.4\\%
(2R,3R,4R,5R,6S)-2-[[(2R,3S,4S,5R,6S)-6-(4-ethenylphenoxy)-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol_49.5\\%
C20H28O10 (428.16823880000004)
(2R,3S,4S,5R,6R)-2-[[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[(E)-3-phenylprop-2-enoxy]oxane-3,4,5-triol_major
C20H28O10 (428.16823880000004)
(2R,3R,4R,5R,6S)-2-[[(2R,3S,4S,5R,6S)-6-(4-ethenylphenoxy)-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol_major
C20H28O10 (428.16823880000004)
5-[(2R,3R,4S,5R,6R)-3,5-dihydroxy-2-(hydroxymethyl)-6-(2-phenylethoxy)oxan-4-yl]oxy-3-hydroxy-3-methyl-5-oxopentanoic acid_major
C20H28O10 (428.16823880000004)
5-[(2R,3R,4S,5R,6R)-3,5-dihydroxy-2-(hydroxymethyl)-6-(2-phenylethoxy)oxan-4-yl]oxy-3-hydroxy-3-methyl-5-oxopentanoic acid_78.7\\%
C20H28O10 (428.16823880000004)
Ala Ala His Met
C17H28N6O5S (428.18417980000004)
Ala Ala Met His
C17H28N6O5S (428.18417980000004)
Ala Cys His Val
C17H28N6O5S (428.18417980000004)
Ala Cys Val His
C17H28N6O5S (428.18417980000004)
Ala Asp His Ser
C16H24N6O8 (428.16555439999996)
Ala Asp Ser His
C16H24N6O8 (428.16555439999996)
Ala His Ala Met
C17H28N6O5S (428.18417980000004)
Ala His Cys Val
C17H28N6O5S (428.18417980000004)
Ala His Asp Ser
C16H24N6O8 (428.16555439999996)
Ala His Met Ala
C17H28N6O5S (428.18417980000004)
Ala His Ser Asp
C16H24N6O8 (428.16555439999996)
Ala His Val Cys
C17H28N6O5S (428.18417980000004)
Ala Met Ala His
C17H28N6O5S (428.18417980000004)
Ala Met His Ala
C17H28N6O5S (428.18417980000004)
Ala Ser Asp His
C16H24N6O8 (428.16555439999996)
Ala Ser His Asp
C16H24N6O8 (428.16555439999996)
Ala Val Cys His
C17H28N6O5S (428.18417980000004)
Ala Val His Cys
C17H28N6O5S (428.18417980000004)
Cys Ala His Val
C17H28N6O5S (428.18417980000004)
Cys Ala Val His
C17H28N6O5S (428.18417980000004)
Cys Gly His Ile
C17H28N6O5S (428.18417980000004)
Cys Gly His Leu
C17H28N6O5S (428.18417980000004)
Cys Gly Ile His
C17H28N6O5S (428.18417980000004)
Cys Gly Leu His
C17H28N6O5S (428.18417980000004)
Cys His Ala Val
C17H28N6O5S (428.18417980000004)
Cys His Gly Ile
C17H28N6O5S (428.18417980000004)
Cys His Gly Leu
C17H28N6O5S (428.18417980000004)
Cys His Ile Gly
C17H28N6O5S (428.18417980000004)
Cys His Leu Gly
C17H28N6O5S (428.18417980000004)
Cys His Val Ala
C17H28N6O5S (428.18417980000004)
Cys Ile Gly His
C17H28N6O5S (428.18417980000004)
Cys Ile His Gly
C17H28N6O5S (428.18417980000004)
Cys Leu Gly His
C17H28N6O5S (428.18417980000004)
Cys Leu His Gly
C17H28N6O5S (428.18417980000004)
Cys Val Ala His
C17H28N6O5S (428.18417980000004)
Cys Val His Ala
C17H28N6O5S (428.18417980000004)
Asp Ala His Ser
C16H24N6O8 (428.16555439999996)
Asp Ala Ser His
C16H24N6O8 (428.16555439999996)
Asp Gly His Thr
C16H24N6O8 (428.16555439999996)
Asp Gly Thr His
C16H24N6O8 (428.16555439999996)
Asp His Ala Ser
C16H24N6O8 (428.16555439999996)
Asp His Gly Thr
C16H24N6O8 (428.16555439999996)
Asp His Ser Ala
C16H24N6O8 (428.16555439999996)
Asp His Thr Gly
C16H24N6O8 (428.16555439999996)
Asp Ser Ala His
C16H24N6O8 (428.16555439999996)
Asp Ser His Ala
C16H24N6O8 (428.16555439999996)
Asp Thr Gly His
C16H24N6O8 (428.16555439999996)
Asp Thr His Gly
C16H24N6O8 (428.16555439999996)
Glu Gly His Ser
C16H24N6O8 (428.16555439999996)
Glu Gly Ser His
C16H24N6O8 (428.16555439999996)
Glu His Gly Ser
C16H24N6O8 (428.16555439999996)
Glu His Ser Gly
C16H24N6O8 (428.16555439999996)
Glu Ser Gly His
C16H24N6O8 (428.16555439999996)
Glu Ser His Gly
C16H24N6O8 (428.16555439999996)
Gly Cys His Ile
C17H28N6O5S (428.18417980000004)
Gly Cys His Leu
C17H28N6O5S (428.18417980000004)
Gly Cys Ile His
C17H28N6O5S (428.18417980000004)
Gly Cys Leu His
C17H28N6O5S (428.18417980000004)
Gly Asp His Thr
C16H24N6O8 (428.16555439999996)
Gly Asp Thr His
C16H24N6O8 (428.16555439999996)
Gly Glu His Ser
C16H24N6O8 (428.16555439999996)
Gly Glu Ser His
C16H24N6O8 (428.16555439999996)
Gly His Cys Ile
C17H28N6O5S (428.18417980000004)
Gly His Cys Leu
C17H28N6O5S (428.18417980000004)
Gly His Asp Thr
C16H24N6O8 (428.16555439999996)
Gly His Glu Ser
C16H24N6O8 (428.16555439999996)
Gly His Ile Cys
C17H28N6O5S (428.18417980000004)
Gly His Leu Cys
C17H28N6O5S (428.18417980000004)
Gly His Ser Glu
C16H24N6O8 (428.16555439999996)
Gly His Thr Asp
C16H24N6O8 (428.16555439999996)
Gly Ile Cys His
C17H28N6O5S (428.18417980000004)
Gly Ile His Cys
C17H28N6O5S (428.18417980000004)
Gly Leu Cys His
C17H28N6O5S (428.18417980000004)
Gly Leu His Cys
C17H28N6O5S (428.18417980000004)
Gly Ser Glu His
C16H24N6O8 (428.16555439999996)
Gly Ser His Glu
C16H24N6O8 (428.16555439999996)
Gly Thr Asp His
C16H24N6O8 (428.16555439999996)
Gly Thr His Asp
C16H24N6O8 (428.16555439999996)
His Ala Ala Met
C17H28N6O5S (428.18417980000004)
His Ala Cys Val
C17H28N6O5S (428.18417980000004)
His Ala Asp Ser
C16H24N6O8 (428.16555439999996)
His Ala Met Ala
C17H28N6O5S (428.18417980000004)
His Ala Ser Asp
C16H24N6O8 (428.16555439999996)
His Ala Val Cys
C17H28N6O5S (428.18417980000004)
His Cys Ala Val
C17H28N6O5S (428.18417980000004)
His Cys Gly Ile
C17H28N6O5S (428.18417980000004)
His Cys Gly Leu
C17H28N6O5S (428.18417980000004)
His Cys Ile Gly
C17H28N6O5S (428.18417980000004)
His Cys Leu Gly
C17H28N6O5S (428.18417980000004)
His Cys Val Ala
C17H28N6O5S (428.18417980000004)
His Asp Ala Ser
C16H24N6O8 (428.16555439999996)
His Asp Gly Thr
C16H24N6O8 (428.16555439999996)
His Asp Ser Ala
C16H24N6O8 (428.16555439999996)
His Asp Thr Gly
C16H24N6O8 (428.16555439999996)
His Glu Gly Ser
C16H24N6O8 (428.16555439999996)
His Glu Ser Gly
C16H24N6O8 (428.16555439999996)
His Gly Cys Ile
C17H28N6O5S (428.18417980000004)
His Gly Cys Leu
C17H28N6O5S (428.18417980000004)
His Gly Asp Thr
C16H24N6O8 (428.16555439999996)
His Gly Glu Ser
C16H24N6O8 (428.16555439999996)
His Gly Ile Cys
C17H28N6O5S (428.18417980000004)
His Gly Leu Cys
C17H28N6O5S (428.18417980000004)
His Gly Ser Glu
C16H24N6O8 (428.16555439999996)
His Gly Thr Asp
C16H24N6O8 (428.16555439999996)
His Ile Cys Gly
C17H28N6O5S (428.18417980000004)
His Ile Gly Cys
C17H28N6O5S (428.18417980000004)
His Leu Cys Gly
C17H28N6O5S (428.18417980000004)
His Leu Gly Cys
C17H28N6O5S (428.18417980000004)
His Met Ala Ala
C17H28N6O5S (428.18417980000004)
His Ser Ala Asp
C16H24N6O8 (428.16555439999996)
His Ser Asp Ala
C16H24N6O8 (428.16555439999996)
His Ser Glu Gly
C16H24N6O8 (428.16555439999996)
His Ser Gly Glu
C16H24N6O8 (428.16555439999996)
His Thr Asp Gly
C16H24N6O8 (428.16555439999996)
His Thr Gly Asp
C16H24N6O8 (428.16555439999996)
His Val Ala Cys
C17H28N6O5S (428.18417980000004)
His Val Cys Ala
C17H28N6O5S (428.18417980000004)
Ile Cys Gly His
C17H28N6O5S (428.18417980000004)
Ile Cys His Gly
C17H28N6O5S (428.18417980000004)
Ile Gly Cys His
C17H28N6O5S (428.18417980000004)
Ile Gly His Cys
C17H28N6O5S (428.18417980000004)
Ile His Cys Gly
C17H28N6O5S (428.18417980000004)
Ile His Gly Cys
C17H28N6O5S (428.18417980000004)
Leu Cys Gly His
C17H28N6O5S (428.18417980000004)
Leu Cys His Gly
C17H28N6O5S (428.18417980000004)
Leu Gly Cys His
C17H28N6O5S (428.18417980000004)
Leu Gly His Cys
C17H28N6O5S (428.18417980000004)
Leu His Cys Gly
C17H28N6O5S (428.18417980000004)
Leu His Gly Cys
C17H28N6O5S (428.18417980000004)
Met Ala Ala His
C17H28N6O5S (428.18417980000004)
Met Ala His Ala
C17H28N6O5S (428.18417980000004)
Met His Ala Ala
C17H28N6O5S (428.18417980000004)
Ser Ala Asp His
C16H24N6O8 (428.16555439999996)
Ser Ala His Asp
C16H24N6O8 (428.16555439999996)
Ser Asp Ala His
C16H24N6O8 (428.16555439999996)
Ser Asp His Ala
C16H24N6O8 (428.16555439999996)
Ser Glu Gly His
C16H24N6O8 (428.16555439999996)
Ser Glu His Gly
C16H24N6O8 (428.16555439999996)
Ser Gly Glu His
C16H24N6O8 (428.16555439999996)
Ser Gly His Glu
C16H24N6O8 (428.16555439999996)
Ser His Ala Asp
C16H24N6O8 (428.16555439999996)
Ser His Asp Ala
C16H24N6O8 (428.16555439999996)
Ser His Glu Gly
C16H24N6O8 (428.16555439999996)
Ser His Gly Glu
C16H24N6O8 (428.16555439999996)
Thr Asp Gly His
C16H24N6O8 (428.16555439999996)
Thr Asp His Gly
C16H24N6O8 (428.16555439999996)
Thr Gly Asp His
C16H24N6O8 (428.16555439999996)
Thr Gly His Asp
C16H24N6O8 (428.16555439999996)
Thr His Asp Gly
C16H24N6O8 (428.16555439999996)
Thr His Gly Asp
C16H24N6O8 (428.16555439999996)
Val Ala Cys His
C17H28N6O5S (428.18417980000004)
Val Ala His Cys
C17H28N6O5S (428.18417980000004)
Val Cys Ala His
C17H28N6O5S (428.18417980000004)
Val Cys His Ala
C17H28N6O5S (428.18417980000004)
Val His Ala Cys
C17H28N6O5S (428.18417980000004)
Val His Cys Ala
C17H28N6O5S (428.18417980000004)
A 922500
A 922500 (DGAT-1 Inhibitor 4a) is a potent, selective, and orally bioavailable diacylglycerol acyltransferase 1 (DGAT-1) inhibitor with IC50s of 9 and 22 nM against human and mouse DGAT-1, respectively.
1-Isomangostin hydrate
Artoflavanone
garcinone D
ptelatoside b
C20H28O10 (428.16823880000004)
3-(1-(3-Methylbutanoyl))-angeloyl vaginidiol
Edulisin V
b-D-Xylopyranosyl-(1->4)-a-L-rhamnopyranosyl-(1->2)-L-arabinose
3-Isomangostin Hydrate
Vinylphenol, O-[L-Rhamnopyranosyl-(1-6)-�-D-glucopyranoside
C20H28O10 (428.16823880000004)
8,8-Dimethyl-9-[(3-methylbutanoyl)oxy]-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-10-yl 3-methyl-2-butenoate
Capivasertib
C21H25ClN6O2 (428.17274199999997)
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C61074 - Serine/Threonine Kinase Inhibitor C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor > C155764 - AKT Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor Capivasertib (AZD5363) is an orally active and potent pan-AKT kinase inhibitor with IC50 of 3, 7 and 7 nM for Akt1,Akt2 and Akt3, respectively.
2-(2-methoxyethoxy)ethyl 4-[(5-cyano-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxopyridin-3-yl)azo]benzoate
6-Des(1-methyl-2-benzimidazolyl)-6-carboxy Telmisartan
ethyl 6-fluoro-1-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)-4-oxo-1,8-naphthyridine-3-carboxylate
ethyl 6-fluoro-1-(4-fluorophenyl)-7-(3-methylpiperazin-1-yl)-4-oxo-1,8-naphthyridine-3-carboxylate
2-Cyclohexene-1-octanoic acid, 5(or 6)-carboxy-4-hexyl-, dipotassium salt
C21H34K2O4 (428.17311240000004)
2-(trimethylsilyl)ethoxymethyltriphenylphosphonium chloride
butanedioic acid,sulfo-,4-dodecyl 1-(2-propenyl)ester,sodium salt
C19H33NaO7S (428.1844588000001)
LOXO-101
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01E - Protein kinase inhibitors C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor > C155765 - TRK Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent
Halobetasol
C22H27ClF2O4 (428.15658360000003)
D - Dermatologicals > D07 - Corticosteroids, dermatological preparations > D07A - Corticosteroids, plain > D07AC - Corticosteroids, potent (group iii) C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents
(R)-3-((N-(1-(4-fluorophenyl)ethyl)quinoline-3-carboxamido)methyl)benzoic acid
2-[1-(4-Chlorobenzoyl)-5-Methoxy-2-Methyl-1h-Indol-3-Yl]-N-[(1r)-1-(Hydroxymethyl)propyl]acetamide
2-[1-(4-Chlorobenzoyl)-5-Methoxy-2-Methyl-1h-Indol-3-Yl]-N-[(1s)-1-(Hydroxymethyl)propyl]acetamide
(3s)-3-Cyclopentyl-6-Methyl-7-[(4-Methylpiperazin-1-Yl)sulfonyl]-3,4-Dihydro-2h-1,2,4-Benzothiadiazine 1,1-Dioxide
Miricorilant
C274 - Antineoplastic Agent > C129818 - Antineoplastic Hormonal/Endocrine Agent > C183052 - Glucocorticoid Receptor Antagonist C147908 - Hormone Therapy Agent
2-[[6-(4-Ethenylphenoxy)-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol
C20H28O10 (428.16823880000004)
2-Methyl-1-[1,3,7,9-tetrahydroxy-4,6-dimethyl-8-(2-methyl-1-oxobutyl)-2-dibenzofuranyl]-1-butanone
3-Methyl-1-[1,3,7,9-tetrahydroxy-2,8-dimethyl-6-(3-methyl-1-oxobutyl)-4-dibenzofuranyl]-1-butanone
2-(3-Phenylprop-2-enoxy)-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol
C20H28O10 (428.16823880000004)
A922500
A 922500 (DGAT-1 Inhibitor 4a) is a potent, selective, and orally bioavailable diacylglycerol acyltransferase 1 (DGAT-1) inhibitor with IC50s of 9 and 22 nM against human and mouse DGAT-1, respectively.
2-[4-chloro-5-(cyclopentylsulfamoyl)-2-methylphenoxy]-N-cyclohexylacetamide
C20H29ClN2O4S (428.15364640000007)
2-Phenylethyl 3-O-(4-carboxy-3-hydroxy-3-methylbutanoyl)-beta-D-glucopyranoside
C20H28O10 (428.16823880000004)
4-(2-azaspiro[5.5]undecan-2-ylsulfonyl)-N-butan-2-ylbenzenesulfonamide
3-(2-Methoxy-ethyl)-11-{[1-(3-methoxy-phenyl)-meth-(E)-ylidene]-amino}-3,11-dihydro-1,3,5,10,11-pent aaza-benzo[b]fluoren-4-one
N-[2-(2-benzamidoethyl)-1-methyl-5-benzimidazolyl]-2-methoxybenzamide
[1-(4-fluorophenyl)sulfonyl-4-piperidinyl]-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone
Cinnamyl 6-O-beta-D-xylopyranosyl-beta-D-glucopyranoside
C20H28O10 (428.16823880000004)
N-[2-[(2R,5S,6R)-5-(1,3-benzodioxole-5-carbonylamino)-6-(hydroxymethyl)oxan-2-yl]ethyl]pyrazine-2-carboxamide
2-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-6-[(4-methoxyphenyl)carbamoylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b][1]benzofuran-3-yl]acetic acid
(1R,9S,10S,11S)-12-(cyclopentanecarbonyl)-10-(hydroxymethyl)-6-oxo-N-(1,3-thiazol-2-yl)-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide
N-[2-[(2S,5R,6S)-5-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyrazinecarboxamide
N-[2-[(2S,5R,6R)-5-(1,3-benzodioxole-5-carbonylamino)-6-(hydroxymethyl)oxan-2-yl]ethyl]pyrazine-2-carboxamide
2-[(1S,3S,4aR,9aS)-1-(hydroxymethyl)-6-[[(4-methoxyanilino)-oxomethyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid
(1S,9R,10R,11R)-12-(cyclopentanecarbonyl)-10-(hydroxymethyl)-6-oxo-N-(1,3-thiazol-2-yl)-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide
N-[2-[(2R,5R,6S)-5-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyrazinecarboxamide
N-[2-[(2S,5S,6S)-5-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyrazinecarboxamide
2-[(1S,3R,4aR,9aS)-1-(hydroxymethyl)-6-[[(4-methoxyanilino)-oxomethyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid
1-[(2S,3R)-2-(hydroxymethyl)-1-[oxo(3-pyridinyl)methyl]-3-phenyl-1,6-diazaspiro[3.3]heptan-6-yl]-2-(2-pyridinyl)ethanone
1-[(2S,3S)-2-(hydroxymethyl)-3-[4-(3-methylphenyl)phenyl]-1-methylsulfonyl-1,6-diazaspiro[3.3]heptan-6-yl]-1-propanone
C23H28N2O4S (428.17696880000005)
1-[(2R,3S)-2-(hydroxymethyl)-3-[4-(3-methylphenyl)phenyl]-1-methylsulfonyl-1,6-diazaspiro[3.3]heptan-6-yl]-1-propanone
C23H28N2O4S (428.17696880000005)
N-[2-[(2R,5R,6R)-5-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyrazinecarboxamide
N-[2-[(2R,5S,6S)-5-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyrazinecarboxamide
N-[2-[(2S,5S,6R)-5-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyrazinecarboxamide
2-[(1S,3R,4aS,9aR)-1-(hydroxymethyl)-6-[[(4-methoxyanilino)-oxomethyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid
(1S)-N-(2,4-difluorophenyl)-1-(hydroxymethyl)-7-methoxy-1-spiro[1,2,3,9-tetrahydropyrido[3,4-b]indole-4,3-azetidine]carboxamide
1-[(2S,3S)-2-(hydroxymethyl)-1-[oxo(3-pyridinyl)methyl]-3-phenyl-1,6-diazaspiro[3.3]heptan-6-yl]-2-(2-pyridinyl)ethanone
1-[(2S,3R)-2-(hydroxymethyl)-3-[4-(3-methylphenyl)phenyl]-1-methylsulfonyl-1,6-diazaspiro[3.3]heptan-6-yl]-1-propanone
C23H28N2O4S (428.17696880000005)
beta-D-Glucopyranoside, 4-ethenylphenyl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-
C20H28O10 (428.16823880000004)
[1-Hydroxy-3-[hydroxy-(3-hydroxy-2-pentanoyloxypropoxy)phosphoryl]oxypropan-2-yl] hexanoate
[1-[(2-Butanoyloxy-3-hydroxypropoxy)-hydroxyphosphoryl]oxy-3-hydroxypropan-2-yl] heptanoate
[1-Hydroxy-3-[hydroxy-(3-hydroxy-2-propanoyloxypropoxy)phosphoryl]oxypropan-2-yl] octanoate
[1-[(2-Acetyloxy-3-hydroxypropoxy)-hydroxyphosphoryl]oxy-3-hydroxypropan-2-yl] nonanoate
[1-[2,3-Dihydroxypropoxy(hydroxy)phosphoryl]oxy-3-pentanoyloxypropan-2-yl] hexanoate
[1-[2,3-Dihydroxypropoxy(hydroxy)phosphoryl]oxy-3-propanoyloxypropan-2-yl] octanoate
[1-Acetyloxy-3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxypropan-2-yl] nonanoate
[1-Butanoyloxy-3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxypropan-2-yl] heptanoate
cratoxylumxanthone C
A member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1, 6 and 7, 3-methylbut-2-en-1-yl group at position 2, methoxy group at position 3, and a 3-hydroxy-3-methylbutyl group at position 8. It is isolated from the stems of Cratoxylum cochinchinense and exhibits anticancer activity.
GSK2194069
GSK2194069 is a potent inhibitor of β-ketoyl reductase (KR) of fatty acid synthase (FASN), with an IC50 value of 7.7 nM. GSK2194069 shows specifically inhibitory effect on FAS expressing cancer cells, by acting potent efficacy on acetoacetyl-CoA, NADPH with IC50 or Ki values of 4.8 nM and 5.6 nM, respectively[1][2][3].
(9r,10r)-8,8-dimethyl-10-[(3-methylbutanoyl)oxy]-2-oxo-9h,10h-pyrano[2,3-h]chromen-9-yl (2z)-2-methylbut-2-enoate
3-[(2r)-2-(2-hydroxypropan-2-yl)-6-{[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzofuran-5-yl]propanoic acid
C20H28O10 (428.16823880000004)
3,6,8-trihydroxy-1-[(3s)-3-hydroxy-3,7-dimethyloct-6-en-1-yl]-2-methoxyxanthen-9-one
2,3,11,12,15,16-hexahydroxy-17-(hydroxymethyl)-9,13-dimethyl-5,18-dioxapentacyclo[12.5.0.0¹,⁶.0²,¹⁷.0⁸,¹³]nonadec-9-en-4-one
C20H28O10 (428.16823880000004)
(4s,6r,6as,9r,10s,10ar)-6-(acetyloxy)-6a,9,10-trihydroxy-3-(methoxymethyl)-6,9-dimethyl-2-oxo-4h,5h,7h,8h,10h-naphtho[4a,4-b]furan-4-yl acetate
C20H28O10 (428.16823880000004)
[(2s,3s,4s,5r,6s)-3,4,5-trihydroxy-6-{4-[(1e)-3-hydroxyprop-1-en-1-yl]-2-methoxyphenoxy}oxan-2-yl]methyl (2s)-3-hydroxy-2-methylpropanoate
C20H28O10 (428.16823880000004)
9-chloro-4,6-dihydroxy-12-methyl-12-(4-methylpent-3-en-1-yl)-15-(propan-2-ylidene)-11-oxatetracyclo[8.6.0.0¹,¹³.0²,⁷]hexadeca-2,4,6,9-tetraen-8-one
C25H29ClO4 (428.17542640000005)
(9s,10s)-8,8-dimethyl-9-[(3-methylbutanoyl)oxy]-2-oxo-9h,10h-pyrano[2,3-h]chromen-10-yl 3-methylbut-2-enoate
(2s)-5-hydroxy-7-methoxy-8-(3-methylbut-2-en-1-yl)-2-(2,4,6-trimethoxyphenyl)-2,3-dihydro-1-benzopyran-4-one
(2r,3s,4s,5r,6r)-2-({[(2r,3r,4r,5s)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-{[(2z)-3-phenylprop-2-en-1-yl]oxy}oxane-3,4,5-triol
C20H28O10 (428.16823880000004)
2-[(8r,9s)-9-{[(2r)-2-methylbutanoyl]oxy}-2-oxo-8h,9h-furo[2,3-h]chromen-8-yl]propan-2-yl (2e)-2-methylbut-2-enoate
2-methyl-1-[3,5,11,13-tetrahydroxy-6,10-dimethyl-12-(2-methylbutanoyl)-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(9),2(7),3,5,10,12-hexaen-4-yl]butan-1-one
2-[(3,4-dihydroxy-5-{4-imino-3h,5h-pyrrolo[3,2-d]pyrimidin-7-yl}oxolan-2-yl)methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
C17H24N4O9 (428.15432139999996)
(1'S,6'R)-8'-hydroxyabscisic acid-β-D-glucoside
C20H28O10 (428.16823880000004)
{"Ingredient_id": "HBIN003318","Ingredient_name": "(1'S,6'R)-8'-hydroxyabscisic acid-\u03b2-D-glucoside","Alias": "NA","Ingredient_formula": "C20H28O10","Ingredient_Smile": "CC1=CC(=O)CC(C1(C=CC(=CC(=O)O)C)O)(C)OC2C(C(C(C(O2)CO)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42430","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(2s)-pteroside k
{"Ingredient_id": "HBIN006825","Ingredient_name": "(2s)-pteroside k","Alias": "NA","Ingredient_formula": "C21H29ClO7","Ingredient_Smile": "CC1=C(C(=C2C(=C1)CC(C2=O)(C)COC3C(C(C(C(O3)CO)O)O)O)C)CCCl","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "18108","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3'(s)-angeroyloxy-4'(r)-isovaleryloxy-3',4'-di-hydroxanthyletin
{"Ingredient_id": "HBIN009717","Ingredient_name": "3'(s)-angeroyloxy-4'(r)-isovaleryloxy-3',4'-di-hydroxanthyletin","Alias": "NA","Ingredient_formula": "C24H28O7","Ingredient_Smile": "CC=C(C)C(=O)OC1C(OC2=C1C3=C(C=C2)C=CC(=O)O3)C(C)(C)OC(=O)CC(C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1239","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(9s,10r)-8,8-dimethyl-10-[(3-methylbutanoyl)oxy]-2-oxo-9h,10h-pyrano[2,3-h]chromen-9-yl (2z)-2-methylbut-2-enoate
(2r,3r,4s,5r,6r)-2-({[(2r,3s,4r,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-{[(2e)-3-phenylprop-2-en-1-yl]oxy}oxane-3,4,5-triol
C20H28O10 (428.16823880000004)
(1s)-1-[5-hydroxy-2,2-dimethyl-6-(3-methylbutanoyl)-8-oxopyrano[2,3-f]chromen-10-yl]propyl acetate
3-{[5,7-dihydroxy-2,2-dimethyl-6-(2-methylpropanoyl)chromen-8-yl]methyl}-6-ethyl-4-hydroxy-5-methylpyran-2-one
[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-{4-[(1e)-3-hydroxyprop-1-en-1-yl]-2-methoxyphenoxy}oxan-2-yl]methyl (2r)-3-hydroxy-2-methylpropanoate
C20H28O10 (428.16823880000004)
3,6,8-trihydroxy-1-[(2e)-7-hydroxy-3,7-dimethyloct-2-en-1-yl]-2-methoxyxanthen-9-one
(4ar,5s,6r,6ar,11as,11br)-5-(acetyloxy)-4a-hydroxy-4,4,11b-trimethyl-7-methylidene-1-oxo-5h,6h,6ah,11h,11ah-phenanthro[3,2-b]furan-6-yl acetate
(1's,2s,2'r,3's,4r,5'r,7'r,8's,9's,12'r)-2',4,12'-trihydroxy-4-[(1r)-1-hydroxyethyl]-12'-isopropyl-8'-methoxy-7'-methyl-4',10'-dioxaspiro[oxolane-2,6'-tetracyclo[7.2.1.0²,⁷.0³,⁵]dodecane]-5,11'-dione
C20H28O10 (428.16823880000004)
(2r,3s,4s,5r,6r)-2-({[(2r,3s,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-{[(2e)-3-phenylprop-2-en-1-yl]oxy}oxane-3,4,5-triol
C20H28O10 (428.16823880000004)
(5r,6r)-5-(3,5-dihydroxyphenyl)-6-(4-hydroxyphenyl)-3-[(1e)-2-(4-hydroxyphenyl)ethenyl]cyclohept-2-en-1-one
{3,4,5-trihydroxy-6-[4-(3-hydroxyprop-1-en-1-yl)-2-methoxyphenoxy]oxan-2-yl}methyl 3-hydroxy-2-methylpropanoate
C20H28O10 (428.16823880000004)
5-chloro-3-(3,4-dihydroxy-3,5-dimethylhept-1-en-1-yl)-7-hydroxy-7-methyl-6-oxo-8,8a-dihydro-1h-isochromen-8-yl acetate
3,6,8-trihydroxy-1-[(3r)-3-hydroxy-3,7-dimethyloct-6-en-1-yl]-2-methoxyxanthen-9-one
(7r,8r,8ar)-5-chloro-3-[(1e,3s,4r,5s)-3,4-dihydroxy-3,5-dimethylhept-1-en-1-yl]-7-hydroxy-7-methyl-6-oxo-8,8a-dihydro-1h-isochromen-8-yl acetate
3-[2-(2-hydroxypropan-2-yl)-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzofuran-5-yl]propanoic acid
C20H28O10 (428.16823880000004)
(1r,2r,3s,4r,5s,9r)-3,4,5-trihydroxy-8,8,16-trimethyl-5-(2-oxopropyl)-19-oxa-7,16-diazahexacyclo[9.6.1.1¹,⁴.0²,⁹.0³,⁷.0¹⁵,¹⁸]nonadeca-11,13,15(18)-triene-6,17-dione
3-[(2r)-2-(2-hydroxypropan-2-yl)-4-{[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzofuran-5-yl]propanoic acid
C20H28O10 (428.16823880000004)
(9r,10r)-8,8-dimethyl-10-{[(2r)-2-methylbutanoyl]oxy}-2-oxo-9h,10h-pyrano[2,3-h]chromen-9-yl (2z)-2-methylbut-2-enoate
(5s,6s)-6-(3,4-dihydroxyphenyl)-5-(3,5-dihydroxyphenyl)-3-[(1e)-2-phenylethenyl]cyclohept-2-en-1-one
6-(3,4-dihydroxyphenyl)-5-(3,5-dihydroxyphenyl)-3-(2-phenylethenyl)cyclohept-2-en-1-one
3-{[4,6-dihydroxy-5-(2-methylpropanoyl)-2-(prop-1-en-2-yl)-2,3-dihydro-1-benzofuran-7-yl]methyl}-6-ethyl-4-hydroxy-5-methylpyran-2-one
2-methyl-1-[3,5,11,13-tetrahydroxy-6,10-dimethyl-12-(3-methylbutanoyl)-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(9),2(7),3,5,10,12-hexaen-4-yl]butan-1-one
3,4-bis(acetyloxy)-2,5-dihydroxy-6-[(2-methylbut-2-enoyl)oxy]cyclohexyl 2-methylbut-2-enoate
C20H28O10 (428.16823880000004)
(5s,6s)-5-(3,5-dihydroxyphenyl)-6-(4-hydroxyphenyl)-3-[(1e)-2-(4-hydroxyphenyl)ethenyl]cyclohept-2-en-1-one
2-({[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[4-(prop-2-en-1-yl)phenoxy]oxane-3,4,5-triol
C20H28O10 (428.16823880000004)
(2r,3r,4s,5s,6r)-2-{[(2e)-3-phenylprop-2-en-1-yl]oxy}-6-({[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol
C20H28O10 (428.16823880000004)
3,6,8-trihydroxy-1-(3-hydroxy-3,7-dimethyloct-6-en-1-yl)-2-methoxyxanthen-9-one
(9r,10r)-8,8-dimethyl-10-[(2-methylbutanoyl)oxy]-2-oxo-9h,10h-pyrano[2,3-h]chromen-9-yl (2e)-2-methylbut-2-enoate
3-[(2r)-2-(2-hydroxypropan-2-yl)-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzofuran-5-yl]propanoic acid
C20H28O10 (428.16823880000004)
3,4,5-trihydroxy-8,8,16-trimethyl-5-(2-oxopropyl)-19-oxa-7,16-diazahexacyclo[9.6.1.1¹,⁴.0²,⁹.0³,⁷.0¹⁵,¹⁸]nonadeca-11,13,15(18)-triene-6,17-dione
3-[(2s)-2-(2-hydroxypropan-2-yl)-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzofuran-5-yl]propanoic acid
C20H28O10 (428.16823880000004)
(1r)-1-[5-hydroxy-2,2-dimethyl-6-(3-methylbutanoyl)-8-oxopyrano[2,3-f]chromen-10-yl]propyl acetate
8-benzoyl-5,7-dihydroxy-6-(3-methylbut-2-en-1-yl)-4-phenyl-3,4-dihydro-1-benzopyran-2-one
2-[4-(prop-2-en-1-yl)phenoxy]-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxane-3,4,5-triol
C20H28O10 (428.16823880000004)
2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[4-(prop-2-en-1-yl)phenoxy]oxane-3,4,5-triol
C20H28O10 (428.16823880000004)
(1r,2r,3r,4s,5s,6r)-3,4-bis(acetyloxy)-2,5-dihydroxy-6-{[(2z)-2-methylbut-2-enoyl]oxy}cyclohexyl (2z)-2-methylbut-2-enoate
C20H28O10 (428.16823880000004)
(2s,3r,4r,5r,6s)-2-{[(2s,3r,4s,5s,6r)-2-(4-ethenylphenoxy)-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol
C20H28O10 (428.16823880000004)
4a,8-dimethyl-3-methylidene-4-[(2-methylprop-2-enoyl)oxy]-2,5-dioxo-3ah,4h,7ah,8h,9h,9ah-azuleno[6,5-b]furan-9-yl 2-methylbut-2-enoate
(3ar,4s,5r,6s,7r,7ar)-6-ethenyl-6-methyl-3-methylidene-7-[(2-methylprop-2-enoyl)oxy]-2-oxo-5-(3-oxoprop-1-en-2-yl)-tetrahydro-3ah-1-benzofuran-4-yl (2z)-2-methylbut-2-enoate
1-[(2r,3s,4s,5r,6r)-6-(benzyloxy)-3,4,5-trihydroxyoxan-2-yl]methyl 5-methyl (3s)-3-hydroxy-3-methylpentanedioate
C20H28O10 (428.16823880000004)
5-(acetyloxy)-4a-hydroxy-4,4,11b-trimethyl-7-methylidene-1-oxo-5h,6h,6ah,11h,11ah-phenanthro[3,2-b]furan-6-yl acetate
(3s)-3-hydroxy-3-methyl-5-oxo-5-{[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-(2-phenylethoxy)oxan-2-yl]methoxy}pentanoic acid
C20H28O10 (428.16823880000004)
(3r)-6,8-dihydroxy-3-{[(3s,4r)-8-hydroxy-3,4,5-trimethyl-3,4-dihydro-1h-2-benzopyran-6-yl]oxy}-3,5,7-trimethyl-4h-2-benzopyran-1-one
(2r,3r,4s,5r,6r)-2-{[(2e)-3-phenylprop-2-en-1-yl]oxy}-6-({[(2r,3r,4r,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol
C20H28O10 (428.16823880000004)
5-(3,5-dihydroxyphenyl)-6-(4-hydroxyphenyl)-3-[2-(4-hydroxyphenyl)ethenyl]cyclohept-2-en-1-one
6-(acetyloxy)-6a,9,10-trihydroxy-3-(methoxymethyl)-6,9-dimethyl-2-oxo-4h,5h,7h,8h,10h-naphtho[4a,4-b]furan-4-yl acetate
C20H28O10 (428.16823880000004)
8,8-dimethyl-10-[(3-methylbutanoyl)oxy]-2-oxo-9h,10h-pyrano[2,3-h]chromen-9-yl 3-methylbut-2-enoate
(2s,3r,4s,5s,6r)-2-[4-(prop-2-en-1-yl)phenoxy]-6-({[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol
C20H28O10 (428.16823880000004)
(3e,5r)-5-[(1s,5s,6e,9z,13s,15s)-10-chloro-5-hydroxy-6-methyl-3-oxo-2,14-dioxabicyclo[11.2.1]hexadeca-6,9-dien-15-yl]-5-hydroxy-3-methylpent-3-enoic acid
(2s)-2-methyl-1-[3,5,11,13-tetrahydroxy-6,10-dimethyl-12-(3-methylbutanoyl)-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(9),2(7),3,5,10,12-hexaen-4-yl]butan-1-one
(9s,10s)-8,8-dimethyl-10-[(3-methylbutanoyl)oxy]-2-oxo-9h,10h-pyrano[2,3-h]chromen-9-yl (2z)-2-methylbut-2-enoate
3-{[(2r)-4,6-dihydroxy-5-(2-methylpropanoyl)-2-(prop-1-en-2-yl)-2,3-dihydro-1-benzofuran-7-yl]methyl}-6-ethyl-4-hydroxy-5-methylpyran-2-one
(2r)-2-methyl-1-{3,5,11,13-tetrahydroxy-6,10-dimethyl-12-[(2r)-2-methylbutanoyl]-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(9),2(7),3,5,10,12-hexaen-4-yl}butan-1-one
2',4,12'-trihydroxy-4-(1-hydroxyethyl)-12'-isopropyl-8'-methoxy-7'-methyl-4',10'-dioxaspiro[oxolane-2,6'-tetracyclo[7.2.1.0²,⁷.0³,⁵]dodecane]-5,11'-dione
C20H28O10 (428.16823880000004)
2-({[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[(3-phenylprop-2-en-1-yl)oxy]oxane-3,4,5-triol
C20H28O10 (428.16823880000004)
(2r)-2-methyl-1-[3,5,11,13-tetrahydroxy-4,12-dimethyl-10-(3-methylbutanoyl)-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(9),2(7),3,5,10,12-hexaen-6-yl]butan-1-one
8,8-dimethyl-10-[(3-methylbutanoyl)oxy]-2-oxo-9h,10h-pyrano[2,3-h]chromen-9-yl 2-methylbut-2-enoate
3,6,8-trihydroxy-1-[(2z)-7-hydroxy-3,7-dimethyloct-2-en-1-yl]-2-methoxyxanthen-9-one
6-ethenyl-6-methyl-3-methylidene-7-[(2-methylprop-2-enoyl)oxy]-2-oxo-5-(3-oxoprop-1-en-2-yl)-tetrahydro-3ah-1-benzofuran-4-yl 2-methylbut-2-enoate
(1r,2r,3r,6r,8s,11s,12s,13s,14r,15r,16s,17r)-2,3,11,12,15,16-hexahydroxy-17-(hydroxymethyl)-9,13-dimethyl-5,18-dioxapentacyclo[12.5.0.0¹,⁶.0²,¹⁷.0⁸,¹³]nonadec-9-en-4-one
C20H28O10 (428.16823880000004)
3-[2-(2-hydroxypropan-2-yl)-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzofuran-5-yl]propanoic acid
C20H28O10 (428.16823880000004)
8-hydroxy-3-methyl-6,9-dimethylidene-2-oxo-octahydro-3h-azuleno[4,5-b]furan-4-yl 3,4-dimethoxybenzoate
(2s,3r,4s,5s,6r)-2-{[(2r,3s,4r,5s)-3,4-dihydroxy-5-{4-imino-3h,5h-pyrrolo[3,2-d]pyrimidin-7-yl}oxolan-2-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
C17H24N4O9 (428.15432139999996)
(4r)-6-benzoyl-5,7-dihydroxy-8-(3-methylbut-2-en-1-yl)-4-phenyl-3,4-dihydro-1-benzopyran-2-one
(9s,10s)-8,8-dimethyl-10-[(3-methylbutanoyl)oxy]-2-oxo-9h,10h-pyrano[2,3-h]chromen-9-yl 3-methylbut-2-enoate
3-[(2s)-2-(2-hydroxypropan-2-yl)-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzofuran-5-yl]propanoic acid
C20H28O10 (428.16823880000004)
8,8-dimethyl-10-[(2-methylbutanoyl)oxy]-2-oxo-9h,10h-pyrano[2,3-h]chromen-9-yl 2-methylbut-2-enoate
(9s,10r)-8,8-dimethyl-10-[(3-methylbutanoyl)oxy]-2-oxo-9h,10h-pyrano[2,3-h]chromen-9-yl (2e)-2-methylbut-2-enoate
(9r,10r)-8,8-dimethyl-10-[(2-methylbutanoyl)oxy]-2-oxo-9h,10h-pyrano[2,3-h]chromen-9-yl (2z)-2-methylbut-2-enoate
19-hydroxy-2,7,7,13,18,21-hexamethyl-6,11,14,16-tetraoxahexacyclo[16.3.1.0³,⁸.0¹⁰,²¹.0¹²,²⁰.0¹⁵,¹⁹]docosa-3,8,12(20)-triene-5,17-dione
(2r,3s,4s,5r,6s)-2-({[(2s,3s,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[4-(prop-2-en-1-yl)phenoxy]oxane-3,4,5-triol
C20H28O10 (428.16823880000004)
(4r)-8-benzoyl-5,7-dihydroxy-6-(3-methylbut-2-en-1-yl)-4-phenyl-3,4-dihydro-1-benzopyran-2-one
(1s,2s,10s,13s,15r,18r,19r,21s)-19-hydroxy-2,7,7,13,18,21-hexamethyl-6,11,14,16-tetraoxahexacyclo[16.3.1.0³,⁸.0¹⁰,²¹.0¹²,²⁰.0¹⁵,¹⁹]docosa-3,8,12(20)-triene-5,17-dione
(3as,4s,4ar,7as,8s,9r,9as)-4a,8-dimethyl-3-methylidene-4-[(2-methylprop-2-enoyl)oxy]-2,5-dioxo-3ah,4h,7ah,8h,9h,9ah-azuleno[6,5-b]furan-9-yl (2z)-2-methylbut-2-enoate
3-[2-(2-hydroxypropan-2-yl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzofuran-5-yl]propanoic acid
C20H28O10 (428.16823880000004)
2-[(1s)-1-butoxyhexyl]-1,3,6,8-tetrahydroxyanthracene-9,10-dione
6-benzoyl-5,7-dihydroxy-8-(3-methylbut-2-en-1-yl)-4-phenyl-3,4-dihydro-1-benzopyran-2-one
3-[2-(2-hydroxypropan-2-yl)-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzofuran-5-yl]propanoic acid
C20H28O10 (428.16823880000004)