Exact Mass: 474.1338
Exact Mass Matches: 474.1338
Found 500 metabolites which its exact mass value is equals to given mass value 474.1338
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within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
3-[({4-[4-({[1-(2-Chlorophenyl)ethoxy]carbonyl}amino)-3-methyl-1,2-oxazol-5-yl]phenyl}methyl)sulfanyl]propanoic acid
Apigenin 7-O-(6'-O-acetylglucoside)
Apigenin 7-O-(6-O-acetylglucoside) is found in german camomile. Apigenin 7-O-(6-O-acetylglucoside) is isolated from Matricaria chamomilla (German chamomile). Isolated from Matricaria chamomilla (German chamomile). 6-Acetylcosmosiin is found in german camomile and herbs and spices.
3'-O-Acetylafzelin
3-O-Acetylafzelin is found in herbs and spices. 3-O-Acetylafzelin is a constituent of Zingiber zerumbet (wild ginger). Constituent of Zingiber zerumbet (wild ginger). 3-O-Acetylafzelin is found in herbs and spices.
alpha-D-Xylopyranosyl-(1->6)-beta-D-glucopyranosyl-(1->4)-D-glucose
Constituent in cell wall polysaccharide of immature barley plants. Isolated from the enzymatic hydrolysates of tamarind polysaccharide. alpha-D-Xylopyranosyl-(1->6)-beta-D-glucopyranosyl-(1->4)-D-glucose is found in cereals and cereal products and fruits. alpha-D-Xylopyranosyl-(1->6)-beta-D-glucopyranosyl-(1->4)-D-glucose is found in cereals and cereal products. Constituent in cell wall polysaccharide of immature barley plants. It is isolated from the enzymatic hydrolysates of tamarind polysaccharide.
Kaempferol 3-(2'-acetylrhamnoside)
Kaempferol 3-(2-acetylrhamnoside) is a constituent of Zingiber zerumbet (wild ginger). Constituent of Zingiber zerumbet (wild ginger)
D-Galactopyranosyl-(1->3)-D-galactopyranosyl-(1->3)-L-arabinose
D-Galactopyranosyl-(1->3)-D-galactopyranosyl-(1->3)-L-arabinose is found in fruits. D-Galactopyranosyl-(1->3)-D-galactopyranosyl-(1->3)-L-arabinose is isolated from the hydrolysate of the gum of Spondias dulcis (ambarella). Isolated from the hydrolysate of the gum of Spondias dulcis (ambarella). D-Galactopyranosyl-(1->3)-D-galactopyranosyl-(1->3)-L-arabinose is found in fruits.
4'-O-Acetylafzelin
4-O-Acetylafzelin is found in herbs and spices. 4-O-Acetylafzelin is a constituent of Zingiber zerumbet (wild ginger). Constituent of Zingiber zerumbet (wild ginger). 4-O-Acetylafzelin is found in herbs and spices.
6'-O-Acetylgenistin
Isolated from seeds of soybean (Glycine max). Therefore, it is present in soy foods suc as miso, soy yogurt, soy milk, and soy bean. 6-O-Acetylgenistin is a potential nutriceutical (having medicinal benefit). 6-O-Acetylgenistin is found in miso. 6-O-Acetylgenistin is isolated from seeds of soybean (Glycine max). 6-O-Acetylgenistin is present in soy foods. Potential nutriceutica
trans-Caffeic acid [apiosyl-(1->6)-glucosyl] ester
trans-Caffeic acid [apiosyl-(1->6)-glucosyl] ester is found in herbs and spices. trans-Caffeic acid [apiosyl-(1->6)-glucosyl] ester is a constituent of Salvia officinalis (sage). Constituent of Salvia officinalis (sage). trans-Caffeic acid [apiosyl-(1->6)-glucosyl] ester is found in herbs and spices.
Betavulgarin glucoside
Betavulgarin glucoside is found in root vegetables. Betavulgarin glucoside is isolated from Beta vulgaris (suger beet) infected with Rhizoctonia solani as a phytoalexin. Isolated from Beta vulgaris (suger beet) infected with Rhizoctonia solani as a phytoalexin. Betavulgarin glucoside is found in root vegetables.
6-Feruloylglucose 2,3,4-trihydroxy-3-methylbutylglycoside
6-Feruloylglucose 2,3,4-trihydroxy-3-methylbutylglycoside is found in herbs and spices. 6-Feruloylglucose 2,3,4-trihydroxy-3-methylbutylglycoside is a constituent of sage (Salvia officinalis) leaf. Constituent of sage (Salvia officinalis) leaf [DFC]. 6-Feruloylglucose 2,3,4-trihydroxy-3-methylbutylglycoside is found in herbs and spices.
Apigenin 7-O-(2'-O-acetylglucoside)
Apigenin 7-O-(2-O-acetylglucoside) is found in german camomile. Apigenin 7-O-(2-O-acetylglucoside) is isolated from Matricaria chamomilla (German chamomile). Isolated from Matricaria chamomilla (German chamomile). 2-Acetylcosmosiin is found in german camomile and herbs and spices.
a-L-Arabinofuranosyl-(1->2)-[a-D-mannopyranosyl-(1->6)]-D-mannose
Residue present in tomato oligosaccharides. a-L-Arabinofuranosyl-(1->2)-[a-D-mannopyranosyl-(1->6)]-D-mannose is found in garden tomato. a-L-Arabinofuranosyl-(1->2)-[a-D-mannopyranosyl-(1->6)]-D-mannose is found in garden tomato. Residue present in tomato oligosaccharides.
Enterolactone 3'-glucuronide
Enterolactone 3-glucuronide is a lignan metabolite produced in the liver. Enterolactone glucuronide is a potential urinary biomarker of whole grain intake (PMID: 23307617).
Enterolactone 3'-glucuronide
Enterolactone 3-glucuronide is a lignan metabolite produced in the liver. Enterolactone glucuronide is a potential urinary biomarker of whole grain intake (PMID: 23307617).
3-[({4-[4-({[1-(2-Chlorophenyl)ethoxy]carbonyl}amino)-3-methyl-1,2-oxazol-5-yl]phenyl}methyl)sulfanyl]propanoic acid
Rilmazafone
Apigenin 7-(6'-O-acetyl)-glucoside
Apigenin 7-(6-o-acetyl)-glucoside is a member of the class of compounds known as flavonoid-7-o-glycosides. Flavonoid-7-o-glycosides are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C7-position. Apigenin 7-(6-o-acetyl)-glucoside is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Apigenin 7-(6-o-acetyl)-glucoside can be found in german camomile, which makes apigenin 7-(6-o-acetyl)-glucoside a potential biomarker for the consumption of this food product.
Viviparum A
Pongamoside D
4,5-Dihydro-11,5-dihydroxy-4-methoxytephrosin
A member of the class of rotenones that is 4,5-dihydrotephrosin substituted by hydroxy groups at positions 11 and 5 and a methoxy group at position 4. It is isolated from the stems of Tephrosia toxicaria and exhibits antineoplastic activity.
6,7-Dihydroxy-3-methyoxy-4,5-methylenedioxyisoflavone 6-O-rhamnoside
9beta-Acetoxy-9beta-(5-acetoxy-tiglinoyloxy)-2-oxo-ludartin
Apigenin 7-(2-acetylglucoside)
6-o-acetylgenistin
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-prop-2-enyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenoxy]oxane-3,4,5-triol
1-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxyphenyl]ethanone
3-(6-methoxy-1,3-benzodioxol-5-yl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(2-hydroxy-4-prop-2-enylphenoxy)oxan-2-yl]methoxy]oxane-3,4,5-triol
(3,4-dihydroxyphenyl)[3-(beta-D-glucopyranosyloxy)-6,7-dihydroxynaphthalen-1-yl]methanone|crassifoside A
2-phenylpropionyl 6-O-beta-D-glucopyranosyl-beta-D-glucopyranoside
4-(3-hydroxyprop-1-enyl)-2-methoxyphenyl 6-O-D-apio-beta-D-furanosyl-beta-D-glucopyranoside|coniferyl alcohol 4-O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside|ligusinenoside A
7,8-trans-8,8-trans-7,8-trans-7,7-bis(5-methoxy-3,4-methylenedioxyphenyl)-8-acetoxymethyl-8-hydroxymethyltetrahydrofuran
5-methoxyphthalide 7-O-beta-D-xylopyranosyl-(1->6)-beta-D-glucopyranoside|5-Methoxyphthalide 7-O-??-xylopyranosyl-(1鈥樏傗垎6)-??-glucopyranoside
11-O-coumaroylbergenin|bergenin 11-O-(E)-coumalate
(1RS,2SR)-1,2-dihydro-7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-6,8-dimethoxynaphthalene-2,3-dicarboxylic acid dimethyl ester|dimethyl (?)-thomasidioate|thomasidioic acid dimethyl ester|trans-thomasidioic acid dimethyl ester
(2R)-2-[(4-hydroxyphenyl)methyl]-3-[4-methoxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-2H-furan-5-one
6-O-acetyl-5-O-beta-D-galactopyranosyl-7,4-dihydroxy-4-phenylcoumarin
1-(4-beta-D-glucopyranosyloxybenzyl)-2-isobutyltartrate|coelovirin A
alpha-L-Araf-(1 -> 4)-beta-D-Galp-(1 -> 6)-alphabeta-D-Galp
O-beta-D-Galactopyranosyl-(1->3)-O-beta-D-galactopyranosyl-(1->4)-D-xylose
2-(benzoyloxymethyl)phenyl (3,6-di-O-acetyl)-beta-D-glucopyranoside
2-(3,4-dihydroxy-4-hydroxymethyltetrahydrofuran-2-yl-oxymethyl)-6-[3-(4-hydroxy-3-methoxyphenyl)allyloxy]tetrahydropyran-3,4,5-triol|coniferyl 9-O-[beta-D-apiofuranosyl(1->6)]-O-beta-D-glucopyranoside
benzoic acid methyl ester 4-O-(3-O-methyl-alpha-L-rhamnopyranosyl)-(1->2)-beta-D-allopyranoside|keteleeroside C
dimethyl (E,E)-4,4?-dihydroxy-3,3?,5,5?-tetramethoxylign-7,7?-dien-9,9?-dioate
3-methoxy-4-O-beta-D-apiofuranosyl-(1?2)-beta-D-glucopyranosylpropiophenone
3-methoxy-4-O-beta-D-apiofuranosyl-(1?6)-beta-D-glucopyranosylpropiophenone
1-O-isopropyl-[5-O-(4-hydroxybenzoyl)-beta-D-apiofuranosyl]-(1?2)-beta-D-glucopyranoside|clausenoside A
4-(4-beta-D-glucopyranosyloxybenzyl)-2-isobutyltartrate|coelovirin B
1,3,6-Trihydroxy-2-methyl-9,10-anthra-quinone-3-O-(6-O-acetyl)-??-D-glucoside|1,3,6-trihydroxy-2-methyl-9,10-anthraquinone-3-O-(6-O-acetyl)-beta-D-glucopyranoside
junipercomnoside E|trans-coniferyl alcohol 9-O-(6-O-alpha-L-arabinofuranosyl)-beta-D-glucopyranoside
8alpha-(5-acetoxysenecioyloxy)-3-oxo-1-desoxy-1,2-dehydrohirsutinolide-13-O-acetate
8-O-beta-D-Glucoside-2-Acetyl-1,6,8-trihydroxy-3-methylanthraquinone
6-O-beta-D-glucopyranosyl-2-O-(2-phenylpropionyl)-D-glucose
Coniferin 2-O-beta-D-apiofuranoside|coniferyl alcohol 4-O-beta-apiofuranosyl-(1->2)-beta-glucopyranoside|coniferylalcohol-4-O-2)>glucoside
O-beta-D-Galactopyranosyl-(1 - > 6)-O-beta-D-galactopyranosyl-(1 - > 3)-L-arabinose|O3-(O6-beta-D-Galactopyranosyl-beta-D-galactopyranosyl)-L-arabinose
Hyperxanthone|Hypholomin A|Hypholomin-A|Hypholomine A
Ki16425
Vandetanib
L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01E - Protein kinase inhibitors C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor > C93259 - VEGFR Tyrosine Kinase Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C163953 - VEGFR-targeting Agent C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C163952 - EGFR-targeting Agent C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor
Oroxylin A 7-O-β-D-glucuronide methyl ester
Baicalein 7-O-β-D-ethylglucuronide
3-(6-methoxy-1,3-benzodioxol-5-yl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
9-methoxy-7-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-[1,3]dioxolo[4,5-g]chromen-8-one
C21H30O12_beta-D-Glucopyranoside, 2-hydroxy-4-(2-propen-1-yl)phenyl 6-O-beta-D-glucopyranosyl
C21H30O12_4-Allyl-2-(beta-D-glucopyranosyloxy)phenyl beta-D-glucopyranoside
C21H30O12_4-Acetyl-2-methoxyphenyl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside
9-methoxy-7-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-[1,3]dioxolo[4,5-g]chromen-8-one
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(2-hydroxy-4-prop-2-enylphenoxy)oxan-2-yl]methoxy]oxane-3,4,5-triol_major
1-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxyphenyl]ethanone_major
Cys Cys Cys Phe
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trans-Caffeic acid [apiosyl-(1->6)-glucosyl] ester
6-Feruloylglucose 2,3,4-trihydroxy-3-methylbutylglycoside
Apigenin 7-(2''-acetylglucoside)
Apigenin 7-(6''-acetylglucoside)
D-Galactopyranosyl-(1->3)-D-galactopyranosyl-(1->3)-L-arabinose
alpha-D-Xylopyranosyl-(1->6)-beta-D-glucopyranosyl-(1->4)-D-glucose
4''-O-Acetylafzelin
3''-O-Acetylafzelin
a-L-Arabinofuranosyl-(1->2)-[a-D-mannopyranosyl-(1->6)]-D-mannose
Betavulgarin glucoside
4-Acetyl-2-methoxyphenyl 6-O-(6-deoxy-?-L-mannopyranosyl)-?-D-glucopyranoside
Rilmazafone
D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D006993 - Hypnotics and Sedatives C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic
[(3aR,4R,5R,6aS)-2-oxo-4-[(E)-3-oxo-4-[3-(trifluoromethyl)phenoxy ]but-1-enyl]-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] benz oate
Methyl 1-C-[3-[[5-(4-fluorophenyl)-2-thienyl]methyl]-4-methylphenyl]-D-glucopyranoside
(4-chlorophenyl)methyl-triphenylphosphanium,tetrafluoroborate
Benzeneacetic acid, 4-chloro-a-[[2-[[[(1,1-dimethylethoxy)carbonyl]amino]iminomethyl]benzo[b]thien-6-yl]oxy]-, methyl ester
Thiazolo[5,4-d]thiazole, 2,5-bis(3-hexyl-2-thienyl)-
Picloxydine
S - Sensory organs > S01 - Ophthalmologicals > S01A - Antiinfectives C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent
Glutaminase C-IN-1
Glutaminase C-IN-1 (Compound 968) is an allosteric inhibitor of Glutaminase C that inhibits cancer cell growth without affecting their normal cellular counterparts[1][2].
2,3,5-Tri-O-benzoyl-2-C-methyl-D-ribonic acid-1,4-lactone
flecainide acetate
D002317 - Cardiovascular Agents > D026941 - Sodium Channel Blockers > D061567 - Voltage-Gated Sodium Channel Blockers C78274 - Agent Affecting Cardiovascular System > C47793 - Antiarrhythmic Agent D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents D049990 - Membrane Transport Modulators C93038 - Cation Channel Blocker
(2S,3R,4S,5S,6R)-2-(3-((5-(4-fluorophenyl)thiophen-2-yl)methyl)-4-methylphenyl)-tetrahydro-6-(hydroxymethyl)-2-methoxy-2H-pyran-3,4,5-triol
3-Methyl-1-octyl-1H-imidazol-3-ium bis[(trifluoromethyl)sulfonyl]methanide
bis(pentamethylcyclopentadienyl)cobalt(iii) hexafluorophosphate
N-(4-CHLORO-2-METHYLPHENYL)-2-(N-(3,4-DIMETHOXYPHENYL)PHENYLSULFONAMIDO)ACETAMIDE
1-N,4-N-bis(3-chlorophenyl)-3,6-dipropyl-1,2,4,5-tetrazine-1,4-dicarboxamide
benzene-1,3-dicarboxylic acid,furan-2,5-dione,3-(3-hydroxypropoxy)propan-1-ol,propane-1,2-diol
1,4,7,10,13,16-Hexaazacyclooctadecane Hexahydrochloride
4-[[(1E)-2-(4-Chlorophenyl)ethenyl]sulfonyl]-1-[[1-(4-pyridinyl)-4-piperidinyl]methyl]piperazinone
methyl 6-benzyl-2-[(2-oxochromene-3-carbonyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
alpha-D-xylosyl-(1->6)-beta-D-glucosyl-(1->4)-beta-D-glucose
(4S)-4-amino-6-({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)-5-oxohexanoic acid
3-(4-chlorophenyl)sulfonyl-N,N-diethyl-7,8-dimethoxytriazolo[1,5-a]quinolin-5-amine
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(E)-4-methyl-6-(3-methyl-1,4-dioxonaphthalen-2-yl)hex-4-enoyl]oxyoxane-2-carboxylic acid
2-[[5-(1-benzotriazolylmethyl)-1,3,4-oxadiazol-2-yl]thio]-N-[(4-fluorophenyl)methyl]-N-phenylacetamide
3-deoxy-4-O-D-glycero-alpha-D-talo-oct-2-ulopyranonosyl-alpha-D-manno-oct-2-ulopyranosonic acid
3-[({4-[4-({[(1S)-1-(2-chlorophenyl)ethoxy]carbonyl}amino)-3-methyl-1,2-oxazol-5-yl]phenyl}methyl)sulfanyl]propanoic acid
3-[({4-[4-({[(1R)-1-(2-chlorophenyl)ethoxy]carbonyl}amino)-3-methyl-1,2-oxazol-5-yl]phenyl}methyl)sulfanyl]propanoic acid
3-[4-(4-Morpholinylsulfonyl)phenyl]propanoic acid [2-(4-acetylanilino)-2-oxoethyl] ester
1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)piperidine-3-carboxamide
alpha-D-mannosyl-(1->6)-[beta-D-xylosyl-(1->2)]-beta-D-mannose
alpha-L-arabinosyl-(1->3)-beta-D-galactosyl-(1->6)-D-galactose
methyl N-(tert-butoxycarbonyl)-3-[2-(2,6-dichlorophenyl)-6-quinolyl]alaninate
N-[(2R,3S,6S)-6-[2-(4-benzyltriazol-1-yl)ethyl]-2-(hydroxymethyl)oxan-3-yl]-2-fluorobenzenesulfonamide
2-[(3R,6aR,8R,10aR)-1-[(3,5-dichlorophenyl)-oxomethyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(2-methoxyethyl)acetamide
(4R,5S,6S)-3-[(3S,5S)-5-[(3-carboxylatophenyl)carbamoyl]pyrrolidin-1-ium-3-yl]sulfanyl-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
2-fluoro-N-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-[4-(phenylmethyl)-1-triazolyl]ethyl]-3-oxanyl]benzenesulfonamide
2-fluoro-N-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-[4-(phenylmethyl)-1-triazolyl]ethyl]-3-oxanyl]benzenesulfonamide
2-fluoro-N-[(2R,3R,6S)-2-(hydroxymethyl)-6-[2-[4-(phenylmethyl)-1-triazolyl]ethyl]-3-oxanyl]benzenesulfonamide
2-[(2S,4aS,12aS)-5-methyl-8-[(2-methylphenyl)sulfonylamino]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid
2-[(2S,4aR,12aR)-5-methyl-8-[(2-methylphenyl)sulfonylamino]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid
2-[(3S,6aS,8S,10aS)-1-(3,5-dichlorobenzoyl)-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(2-methoxyethyl)acetamide
2-[(3S,6aR,8S,10aR)-1-[(3,5-dichlorophenyl)-oxomethyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(2-methoxyethyl)acetamide
2-fluoro-N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-[4-(phenylmethyl)-1-triazolyl]ethyl]-3-oxanyl]benzenesulfonamide
2-fluoro-N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-[4-(phenylmethyl)-1-triazolyl]ethyl]-3-oxanyl]benzenesulfonamide
N-[(2R,3S,6R)-6-[2-[4-(4-fluorophenyl)-1-triazolyl]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-methylbenzenesulfonamide
N-[(2R,3R,6R)-6-[2-[4-(4-fluorophenyl)-1-triazolyl]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-methylbenzenesulfonamide
N-[(2S,3S,6R)-6-[2-[4-(4-fluorophenyl)-1-triazolyl]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-methylbenzenesulfonamide
2-[(2S,4aR,12aS)-5-methyl-8-[(2-methylphenyl)sulfonylamino]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid
2-[(2S,4aS,12aR)-5-methyl-8-[(2-methylphenyl)sulfonylamino]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid
2-[(2R,4aS,12aS)-5-methyl-8-[(2-methylphenyl)sulfonylamino]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid
2-[(2R,4aS,12aS)-8-[[(3,5-difluorophenyl)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid methyl ester
2-[(3R,6aR,8S,10aR)-1-[(3,5-dichlorophenyl)-oxomethyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(2-methoxyethyl)acetamide
2-[(3S,6aS,8R,10aS)-1-[(3,5-dichlorophenyl)-oxomethyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(2-methoxyethyl)acetamide
2-fluoro-N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-[4-(phenylmethyl)-1-triazolyl]ethyl]-3-oxanyl]benzenesulfonamide
2-fluoro-N-[(2S,3R,6R)-2-(hydroxymethyl)-6-[2-[4-(phenylmethyl)-1-triazolyl]ethyl]-3-oxanyl]benzenesulfonamide
N-[(2S,3R,6S)-6-[2-[4-(4-fluorophenyl)-1-triazolyl]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-methylbenzenesulfonamide
N-[(2S,3S,6S)-6-[2-[4-(4-fluorophenyl)-1-triazolyl]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-methylbenzenesulfonamide
N-[(2S,3R,6R)-6-[2-[4-(4-fluorophenyl)-1-triazolyl]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-methylbenzenesulfonamide
N-[(2R,3S,6S)-6-[2-[4-(4-fluorophenyl)-1-triazolyl]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-methylbenzenesulfonamide
N-[(2R,3R,6S)-6-[2-[4-(4-fluorophenyl)-1-triazolyl]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-methylbenzenesulfonamide
2-[(2R,4aR,12aR)-5-methyl-8-[(2-methylphenyl)sulfonylamino]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid
2-[(2R,4aR,12aS)-5-methyl-8-[(2-methylphenyl)sulfonylamino]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid
2-[(3R,6aS,8R,10aS)-1-[(3,5-dichlorophenyl)-oxomethyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(2-methoxyethyl)acetamide
2-[(3R,6aS,8S,10aS)-1-[(3,5-dichlorophenyl)-oxomethyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(2-methoxyethyl)acetamide
N-[4-[[4-(3-cyanobenzoyl)piperazin-1-yl]methyl]phenyl]-4-methylbenzenesulfonamide
5-Methoxy-4-(beta-D-glucopyranosyloxy)-6,7-(methylenedioxy)isoflavone
[2-Butanoyloxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropyl] butanoate
[1-[Hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-3-propanoyloxypropan-2-yl] pentanoate
[1-Acetyloxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropan-2-yl] hexanoate
1,2-dibutyryl-sn-glycero-3-phospho-(1D-myo-inositol)
A 1-phosphatidyl-1D-myo-inositol in which the two phosphatidyl acyl groups are specified as butanoyl.
5,7-dimethyl-2-methylamino-4-(3-pyridylmethyl)-1,3-benzothiazol-6-yl beta-D-glucuronide(1-)
A beta-D-glucosiduronate that is the conjugate base of E3040 glucuronide, obtained by the deprotonation of the carboxy group; major species at pH 7.3.
ertapenem(1-)
The mono-anion resulting from the removal of a proton from one of the carboxyic acid groups of ertapenem.
1,3,6-trihydroxy-2-methyl-9,10-anthraquinone-3-O-(6-O-acetyl)-beta-D-glucopyranoside
A monosaccharide derivative that is 1,3,6-trihydroxy-2-methyl-9,10-anthraquinone attached to a (6-O-acetyl)-beta-D-glucopyranosyl residue at position 3 via a glycosidic linkage. It has been isolated from the roots of Rubia yunnanensis.
GluN2B-NMDAR antagonist-1
GluN2B-NMDAR antagonist-1 is an orally active GluN2B-NMDAR antagonist. GluN2B-NMDAR antagonist-1 has neuroprotective activity. GluN2B-NMDAR antagonist-1 can be used for research of ischemic injury[1].
6,11,14-trihydroxy-5,17,18-trimethoxy-7,7-dimethyl-2,8,21-trioxapentacyclo[12.8.0.0³,¹².0⁴,⁹.0¹⁵,²⁰]docosa-3,9,11,15(20),16,18-hexaen-13-one
(2r,3r,4s,5r,6s)-4-{[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-2-(hydroxymethyl)-6-{4-[(1e)-3-hydroxyprop-1-en-1-yl]-2-methoxyphenoxy}oxane-3,5-diol
(2s,3s,4r,5r,6s)-4,5-dihydroxy-6-{[5-hydroxy-2-(4-methoxyphenyl)-4-oxochromen-7-yl]oxy}-3-methoxyoxane-2-carboxylic acid
3-{2-[(5,7-dihydroxy-3-methoxy-6-methyl-1-oxo-3h-2-benzofuran-4-yl)oxy]-6-methoxy-3-(methoxycarbonyl)-4-methylphenyl}prop-2-enoic acid
(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl (2s)-2-phenylpropanoate
{[2-amino-1,4-dihydroxy-5-(c-hydroxycarbonimidoyloxy)pentylidene]amino}[3,4-dihydroxy-5-(5-methyl-2,4-dioxo-3h-pyridin-1-yl)oxolan-2-yl]acetic acid
(2s,3r,4s,5s,6r)-2-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-8-yl]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl acetate
methyl 2-[(5z)-9-(acetyloxy)-5-(2-methoxy-2-oxoethylidene)-7,8-dimethyl-2,13,15-trioxatetracyclo[8.6.1.0⁴,¹⁷.0¹²,¹⁶]heptadeca-1(17),10,12(16)-trien-4-yl]-2-oxoacetate
4,5-dihydroxy-6-{[5-hydroxy-2-(4-methoxyphenyl)-4-oxochromen-7-yl]oxy}-3-methoxyoxane-2-carboxylic acid
[(2r,3s,4s,5r,6s)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl 8-hydroxy-6-methoxy-3-methyl-9,10-dioxoanthracene-2-carboxylate
methyl 6,6a,7,10a,12-pentahydroxy-3,8-dimethoxy-1-methyl-10,11-dioxo-6,7-dihydrotetracene-2-carboxylate
5,13,17,19-tetrahydroxy-15,22-dioxo-7-(2-oxopropyl)pentacyclo[12.8.0.0³,¹².0⁴,⁹.0¹⁶,²¹]docosa-1(14),2,4(9),5,7,12,16,18,20-nonaene-6-carboxylic acid
2-acetyl-5-hydroxy-3-(4-hydroxyphenyl)-7-{[(2s,5s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
2,3-dimethyl 7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-6,8-dimethoxy-1,2-dihydronaphthalene-2,3-dicarboxylate
(16r,18r,19s,20s,21r,23s,25r)-21-(hydroxymethyl)-15,17,22,24-tetraoxahexacyclo[12.12.0.0²,⁷.0⁸,¹³.0¹⁶,²⁵.0¹⁸,²³]hexacosa-1(14),2(7),3,5,8(13),9,11-heptaene-4,5,10,11,19,20-hexol
(2r,3r,4r,5s,6s)-2-{[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy}-3,5-dihydroxy-6-methyloxan-4-yl acetate
9,10'-dihydroxy-2',3-dimethyl-[2,9'-bianthracene]-1,1',4,4'-tetrone
[4-(hydroxymethyl)-2,5-bis(7-methoxy-2h-1,3-benzodioxol-5-yl)oxolan-3-yl]methyl acetate
(4s,18r)-18-isopropyl-4,7-dimethyl-6-oxa-13,20-dithia-3,10,17,22,23,24-hexaazatetracyclo[17.2.1.1⁵,⁸.1¹²,¹⁵]tetracosa-1(21),2,5(24),7,9,12(23),14,16,19(22)-nonaene-2,9,16-triol
3,4,6,8-tetrahydroxy-1-phenanthrenecarboxylic acid; 3,4-methylene,8-me ether,6-o-beta-d-glucopyranoside
{"Ingredient_id": "HBIN007312","Ingredient_name": "3,4,6,8-tetrahydroxy-1-phenanthrenecarboxylic acid; 3,4-methylene,8-me ether,6-o-beta-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C23H22O11","Ingredient_Smile": "NA","Ingredient_weight": "0","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8305","PubChem_id": "NA","DrugBank_id": "NA"}
8-methoxy-3,4-methylenedioxy-1-phenanthrenecarboxylic acid; 6-hydroxy,o-beta-d-glucopyranoside
{"Ingredient_id": "HBIN013804","Ingredient_name": "8-methoxy-3,4-methylenedioxy-1-phenanthrenecarboxylic acid; 6-hydroxy,o-beta-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C23H22O11","Ingredient_Smile": "NA","Ingredient_weight": "0","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7341","PubChem_id": "NA","DrugBank_id": "NA"}
anticancerrotenoid pmv70p691-036
{"Ingredient_id": "HBIN016352","Ingredient_name": "anticancerrotenoid pmv70p691-036","Alias": "NA","Ingredient_formula": "C24H26O10","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1436","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
beta-d-xylopyranosyl-(1-6)-alpha-d-glucopyranosl-(1-6)-beta-d-glucopyranoside
{"Ingredient_id": "HBIN018087","Ingredient_name": "beta-d-xylopyranosyl-(1-6)-alpha-d-glucopyranosl-(1-6)-beta-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C17H30O15","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "32241","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}