Exact Mass: 490.1659
Exact Mass Matches: 490.1659
Found 500 metabolites which its exact mass value is equals to given mass value 490.1659
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
BMS-268770
Phloroacetophenone 6'-[xylosyl-(1->6)-glucoside]
Phloroacetophenone 6-[xylosyl-(1->6)-glucoside] is found in fats and oils. Phloroacetophenone 6-[xylosyl-(1->6)-glucoside] is a constituent of Sapium sebiferum (Chinese tallowtree). Constituent of Sapium sebiferum (Chinese tallowtree). Phloroacetophenone 6-[xylosyl-(1->6)-glucoside] is found in fats and oils.
Edulisin I
Edulisin I is found in green vegetables. Edulisin I is a constituent of Angelica edulis
4',5,6-Trimethylscutellarein 7-glucoside
4,5,6-Trimethylscutellarein 7-glucoside is found in fruits. 4,5,6-Trimethylscutellarein 7-glucoside is a constituent of Juniperus communis (juniper). Constituent of Juniperus communis (juniper). 4,5,6-Trimethylscutellarein 7-glucoside is found in fruits.
Apogossypolone
gamma-Secretase Inhibitor XXI
Tesevatinib
3-(4-Hydroxyphenyl)-5-methoxy-6-(3,3-dimethylallyl)-2,2-dimethylchromene-(5,6:8,7)-3-(propyl-2-one)-4H-1-benzo-2,3-dihydropyran-2,4-dione
8-Prenyllepidissipyrone
5alpha,6beta,8alpha,12alpha-Tetrahydroxy-28-norisotoonafolin
7-Hydroxy-2,4,5-trimethoxyisoflavone 7-O-glucoside
5-Hydroxy-7,4-dimethoxy-6,8-di-C-prenylflavanone 5-O-galactoside
LETHEDOSIDE A
3,4,7-Tri-O-methylisoorientin
3,4,5,7-Tetra-Me ether,3-O-L-arabinoside-3,3,4,5,7-Pentahydroxyflavone
2,3,4,5-Tetrahydroxyhexyl glycoside-beta-D-Pyranose-6-O-(3,4-Dihydroxycinnamoyl)glucose
3-(4-Hydroxyphenyl)-5-methoxy-8,8-dimethyl-6-(3-methyl-2-butenyl)-3-(2-oxopropyl)-2H,8H-benzo[1,2-b:3,4-b]dipyran-2,4(3H)-dione
(2RS)-2-(4-O-beta-D-glucopyranosylphenyl) propionyl beta-D-glucopyranoside
7,8-trans-8,8-trans-7,8-cis-7-(5-methoxy-3,4-methylenedioxyphenyl)-7-(3,4,5-trimethoxyphenyl)-8-acetoxymethyl-8-hydroxymethyltetrahydrofuran
5-hydroxy-6-methyl-7,4-dimethoxyflavone-8-O-beta-D-glucopyranoside
<3-(1-beta-D-glucosyloxy)-2-hydroxy>benzoyl 3-(3-phthalidyl)-propyl ester|[3-(1-beta-D-glucosyloxy)-2-hydroxy]benzoyl 3-(3-phthalidyl)-propyl ester
2-(3,4-methylenedioxyphenyl)-ethyl-(6-O-caffeoyl)-beta-D-glucopyranoside
3-methoxybenzoic acid methyl ester 4-O-alpha-L-rhamnopyranosyl-(1->2)-beta-D-allopyranoside|keteleeroside A
3-hydroxybenzoic acid methyl ester 4-O-(3-O-methyl-alpha-L-rhamnopyranosyl)-(1->2)-beta-D-allopyranoside|keteleeroside B
1-kestose|beta-D-Fruf-(2->1)-beta-D-Fruf-(2<->1)-alpha-D-Glcp
(5S)-6-O-(4-hydroxy cinnamoyl)-1-O-beta-D-glucopyranosyl-geraniol-5,10-olide|sibiraglycoside E
(-)-(E)-3,5-dimethoxyphenylpropenoic acid 4-O-beta-D-(6-O-benzoyl)glucopyranoside
3-formyl-6,4-dihydroxy-2-methoxy-5-methylchalcone 4-O-beta-D-glucopyranoside
7-(2,3-Dihydroxy-3-methylbutoxy)-2-(3,4-dimethoxyphenyl)-3,5,8-trimethoxy-4H-1-benzopyran-4-one
2,6-dihydroxy-4-methoxy-acetophenone 2-O-beta-rutinoside
everninic acid methyl ester 2-O-beta-D-xylopyranosyl-(1->6)-beta-D-glucopyranoside|Everninic acid methyl ester 2-O-??-xylopyranosyl-(1鈥樏傗垎6)-??-glucopyranoside
3,4,6-TRIMETHOXYISOFLAVONE-7-O-EC-D-GLUCOPYRANOSIDE
(1betaH,5beta,6alpha,8beta,9beta,10alpha)-8-Angeloyl,6-(2,3-epoxy-2-methylbntanoyl):2,6,8-Trihydroxy-4(15),11(13)-elemadiene-3,1:12,9-diolide
2,4-dihydroxy-6-methoxy-3-methylacetophenone 4-O-alpha-L-arabinofuranosyl(1->6)-beta-D-glucopyranoside
(7S,8R)-dehydrodiconiferyl alcohol 9-beta-glucopyranoside
(2S,4R)-7-hydroxy-4-methoxy-6-methoxymethyl-8-methyl-4,2-oxidoflavan-5-O-beta-D-glucopyranoside|abacopterin H
(R)-6-hydroxymellein 6-O-beta-D-[6-O-(4-methoxybenzoyl)]->6)glucopyranoside
1alpha-hydroperoxyligustrin-8-O-(4-hydroxy-5-O-sarracionyl)-sarracinate|1alpha-hydroperoxyligustrin-8-O-<4-hydroxy-5-O-sarracionyl>-sarracinate
2,3-trans-3,4-cis-3-acetoxymethyl-4-[(5-methoxy-3,4-methylenedioxyphenyl)(3,4,5-trimethoxyphenyl)methyl]tetrahydrofuran-2-ol
Asp Glu Ile Asp
Asn Thr Gln Glu
Asp Gln Asn Asp
6-O-β-Apiofuranosylsweroside
6-O-beta-D-Apiofuranosylsweroside is a natural product found in Lonicera quinquelocularis with data available.
Tectoruside
C21H30O13_(4aS,5R,6S)-1-Oxo-5-vinyl-4,4a,5,6-tetrahydro-1H,3H-pyrano[3,4-c]pyran-6-yl 6-O-[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-D-glucopyranoside
C21H30O13_(1S,4aS,7aR)-4a-[(6-Deoxy-alpha-L-mannopyranosyl)oxy]-7-methyl-5-oxo-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-1-yl beta-D-glucopyranoside
(3S,4R,4aS)-3-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-ethenyl-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-8-one
(1S,4aS,7aR)-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,7a-dihydrocyclopenta[c]pyran-5-one
(3S,4R,4aS)-3-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-ethenyl-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-8-one_major
(1S,4aS,7aR)-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,7a-dihydrocyclopenta[c]pyran-5-one_major
Cys Cys Glu His
Cys Cys His Glu
Cys Glu Cys His
Cys Glu His Cys
Cys His Cys Glu
Cys His Glu Cys
Cys His Met Thr
Cys His Thr Met
Cys Met His Thr
Cys Met Thr His
Cys Thr His Met
Cys Thr Met His
Asp Asp Glu Ile
Asp Asp Glu Leu
Asp Asp Ile Glu
Asp Asp Lys Asn
Asp Asp Leu Glu
Asp Asp Asn Lys
Asp Asp Asn Gln
Asp Asp Gln Asn
Asp Glu Asp Ile
Asp Glu Asp Leu
Asp Glu Glu Val
Asp Glu Leu Asp
Asp Glu Met Pro
Asp Glu Asn Asn
Asp Glu Pro Met
Asp Glu Val Glu
Asp Gly His Tyr
Asp Gly Asn Trp
Asp Gly Trp Asn
Asp Gly Tyr His
Asp His Gly Tyr
Asp His Tyr Gly
Asp Ile Asp Glu
Asp Ile Glu Asp
Asp Lys Asp Asn
Asp Lys Asn Asp
Asp Leu Asp Glu
Asp Leu Glu Asp
Asp Met Glu Pro
Asp Met Pro Glu
Asp Asn Asp Lys
Asp Asn Asp Gln
Asp Asn Glu Asn
Asp Asn Gly Trp
Asp Asn Lys Asp
Asp Asn Asn Glu
Asp Asn Gln Asp
Asp Asn Trp Gly
Asp Pro Glu Met
Asp Pro Met Glu
Asp Gln Asp Asn
Asp Gln Gln Thr
Asp Gln Thr Gln
Asp Thr Gln Gln
Asp Val Glu Glu
Asp Trp Gly Asn
Asp Trp Asn Gly
Asp Tyr Gly His
Asp Tyr His Gly
Glu Cys Cys His
Glu Cys His Cys
Glu Asp Asp Ile
Glu Asp Asp Leu
Glu Asp Glu Val
Glu Asp Ile Asp
Glu Asp Leu Asp
Glu Asp Met Pro
Glu Asp Asn Asn
Glu Asp Pro Met
Glu Asp Val Glu
Glu Glu Asp Val
Glu Glu Val Asp
Glu His Cys Cys
Glu Ile Asp Asp
Glu Leu Asp Asp
Glu Met Asp Pro
Glu Met Pro Asp
Glu Asn Asp Asn
Glu Asn Asn Asp
Glu Asn Gln Thr
Glu Asn Thr Gln
Glu Pro Asp Met
Glu Pro Met Asp
Glu Gln Asn Thr
Glu Gln Gln Ser
Glu Gln Ser Gln
Glu Gln Thr Asn
Glu Ser Gln Gln
Glu Thr Asn Gln
Glu Thr Gln Asn
Glu Val Asp Glu
Glu Val Glu Asp
Phe Gly His Met
Phe Gly Met His
Phe His Gly Met
Phe His Met Gly
Phe Met Gly His
Phe Met His Gly
Gly Asp His Tyr
Gly Asp Asn Trp
Gly Asp Trp Asn
Gly Asp Tyr His
Gly Phe His Met
Gly Phe Met His
Gly His Asp Tyr
Gly His Phe Met
Gly His Met Phe
Gly His Tyr Asp
Gly Met Phe His
Gly Met His Phe
Gly Asn Asp Trp
Gly Asn Trp Asp
Gly Trp Asp Asn
Gly Trp Asn Asp
Gly Tyr Asp His
Gly Tyr His Asp
His Cys Cys Glu
His Cys Glu Cys
His Cys Met Thr
His Cys Thr Met
His Asp Gly Tyr
His Asp Tyr Gly
His Glu Cys Cys
His Phe Gly Met
His Phe Met Gly
His Gly Asp Tyr
His Gly Phe Met
His Gly Met Phe
His Gly Tyr Asp
His Met Cys Thr
His Met Phe Gly
His Met Gly Phe
His Met Thr Cys
His Thr Cys Met
His Thr Met Cys
His Tyr Asp Gly
His Tyr Gly Asp
Ile Asp Asp Glu
Ile Asp Glu Asp
Ile Glu Asp Asp
Lys Asp Asp Asn
Leu Asp Asp Glu
Leu Asp Glu Asp
Leu Glu Asp Asp
Met Cys His Thr
Met Cys Thr His
Met Asp Glu Pro
Met Asp Pro Glu
Met Glu Asp Pro
Met Glu Pro Asp
Met Phe Gly His
Met Phe His Gly
Met Gly Phe His
Met Gly His Phe
Met His Cys Thr
Met His Phe Gly
Met His Gly Phe
Met His Thr Cys
Met Pro Asp Glu
Met Pro Glu Asp
Met Thr Cys His
Met Thr His Cys
Asn Asp Asp Gln
Asn Asp Glu Asn
Asn Asp Gly Trp
Asn Asp Asn Glu
Asn Asp Gln Asp
Asn Asp Trp Gly
Asn Glu Asp Asn
Asn Glu Asn Asp
Asn Gly Asp Trp
Asn Gly Trp Asp
Asn Asn Asp Glu
Asn Asn Glu Asp
Asn Gln Asp Asp
Asn Trp Asp Gly
Asn Trp Gly Asp
Pro Asp Glu Met
Pro Asp Met Glu
Pro Glu Asp Met
Pro Glu Met Asp
Pro Met Asp Glu
Pro Met Glu Asp
Gln Asp Asp Asn
Gln Asp Asn Asp
Gln Asn Asp Asp
Thr Cys His Met
Thr Cys Met His
Thr His Cys Met
Thr His Met Cys
Thr Met Cys His
Thr Met His Cys
Val Asp Glu Glu
Val Glu Asp Glu
Val Glu Glu Asp
Trp Asp Gly Asn
Trp Asp Asn Gly
Trp Gly Asp Asn
Trp Gly Asn Asp
Trp Asn Asp Gly
Trp Asn Gly Asp
Tyr Asp Gly His
Tyr Asp His Gly
Tyr Gly Asp His
Tyr Gly His Asp
Tyr His Asp Gly
Tyr His Gly Asp
6-Hydroxykaempferol 3,6-dimethyl ether 7-glucoside
Edulisin I
Phloroacetophenone 6'-[xylosyl-(1->6)-glucoside]
4',5,6-Trimethylscutellarein 7-glucoside
6-O--D-Apiofuranosylsweroside
3,4,5-triethoxy-N-[3-[2-(1,2,4-oxadiazol-3-yl)pyridin-4-yl]oxyphenyl]benzamide
2-benzofuran-1,3-dione,ethane-1,2-diol,furan-2,5-dione,2-(2-hydroxyethoxy)ethanol,propane-1,2-diol
β-Funaltrexamine hydrochloride,(E)-4-[[5α,6β)-17-Cyclopropylmethyl)-4,5-epoxy-3,14-dihydroxymorphinan-6-yl]amino]-4-oxo-2-butenoicacidmethylesterhydrochloride
Methyl 2,3-Di-O-benzoyl-4,6-O-benzylidene-α-D-glucopyranoside
methyl 2,3-di-o-benzoyl-4,6-o-benzylidene-beta-d-glucopyranoside
XL-647
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor D004791 - Enzyme Inhibitors > D047428 - Protein Kinase Inhibitors C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor D000970 - Antineoplastic Agents
N,O-BIS(4-METHOXYBENZYLOXYCARBONYL)-(S)-2-AMINO-3-(4-HYDROXYPHENYL)-PROPIONITRILE
Glasdegib maleate
C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C188731 - Hedgehog Pathway Inhibitor C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor
gamma-Secretase Inhibitor XXI
D004791 - Enzyme Inhibitors > D000091062 - Gamma Secretase Inhibitors and Modulators
Benzeneacetamide, N-(5-(((5-(1,1-dimethylethyl)-2-oxazolyl)methyl)thio)-2-thiazolyl)-4-(((2-hydroxy-1-(hydroxymethyl)ethyl)amino)methyl)-
N,6-dimethyl-2-[[[4-[(2-methyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide
N-(1-Cyanocyclopropyl)-3-({[(2S)-5-oxopyrrolidin-2-YL]methyl}sulfonyl)-N~2~-[(1S)-2,2,2-trifluoro-1-(4-fluorophenyl)ethyl]-L-alaninamide
3-[2-(4-chlorophenyl)-5,7-dimethyl-6-pyrazolo[1,5-a]pyrimidinyl]-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]propanamide
1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]piperidine-4-carboxamide
2-[5-[(Z)-[1-(4-tert-butylphenyl)-5-oxo-3-phenylpyrazol-4-ylidene]methyl]furan-2-yl]benzoic acid
1-(3-Carboxypropyl)-9-(dimethylamino)-11,11-dimethyl-2,3,4,11-tetrahydronaphtho[2,3-g]quinolinium perchlorate
1-(4-Bromophenyl)-2-[3-[hydroxy(diphenyl)methyl]-1-azoniabicyclo[2.2.2]octan-1-yl]ethanone
N-benzyl-4-[2-[2-[(5-methyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]butanamide
6-Methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid [2-[4-methyl-3-(1-piperidinylsulfonyl)anilino]-2-oxoethyl] ester
2-[4-((1R,2R,6S,7S)-3,5-Dioxo-4-aza-tricyclo[5.2.1.0*2,6*]dec-8-en-4-yl)-benzoylamino]-4,5,6,7-tetrahydro-benzo[b]thiophene-3-carboxylic acid ethyl ester
N-[2-[1,3-benzodioxol-5-yl-[2-(cyclopentylamino)-2-oxo-1-pyridin-4-ylethyl]amino]-2-oxoethyl]-2-furancarboxamide
N-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-pyridinecarboxamide
(2S,3S,3aR,9bR)-N-ethyl-7-(4-fluorophenyl)-3-(hydroxymethyl)-6-oxo-1-[1-oxo-2-(3-pyridinyl)ethyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide
(2R,3R,3aS,9bS)-N-ethyl-7-(4-fluorophenyl)-3-(hydroxymethyl)-6-oxo-1-[1-oxo-2-(3-pyridinyl)ethyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide
(2S,3S,3aR,9bR)-1-(2-fluorobenzoyl)-3-(hydroxymethyl)-6-oxo-N-propyl-7-pyridin-3-yl-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide
N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-pyridinecarboxamide
N-[[(4R,5S)-8-(3-fluorophenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylcyclopropanecarboxamide
3-fluoro-N-[[(4R,5S)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-[(E)-prop-1-enyl]-4,5-dihydro-3H-6,1lambda6,2-benzoxathiazocin-5-yl]methyl]-N-methylbenzamide
2-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
2-[(1S,3R,4aS,9aR)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
2-[(1S,3S,4aR,9aS)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
2-[(1S,3R,4aR,9aS)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
(2R,3R,3aS,9bS)-1-[(2-fluorophenyl)-oxomethyl]-3-(hydroxymethyl)-6-oxo-N-propyl-7-(3-pyridinyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide
[(1S)-7-methoxy-9-methyl-2-methylsulfonyl-1-(2-thiazolylmethyl)-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,4-piperidine]yl]methanol
N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-pyridinecarboxamide
N-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-pyridinecarboxamide
N-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-pyridinecarboxamide
N-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-pyridinecarboxamide
N-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-pyridinecarboxamide
N-[[(4S,5S)-8-(3-fluorophenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylcyclopropanecarboxamide
N-[[(4R,5R)-8-(3-fluorophenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylcyclopropanecarboxamide
N-[[(4S,5R)-8-(3-fluorophenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylcyclopropanecarboxamide
N-[[(4S,5R)-8-(3-fluorophenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylcyclopropanecarboxamide
N-[[(4S,5S)-8-(3-fluorophenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylcyclopropanecarboxamide
N-[[(4R,5S)-8-(3-fluorophenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylcyclopropanecarboxamide
N-[[(4R,5R)-8-(3-fluorophenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylcyclopropanecarboxamide
3-fluoro-N-[[(4R,5R)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-[(E)-prop-1-enyl]-4,5-dihydro-3H-6,1lambda6,2-benzoxathiazocin-5-yl]methyl]-N-methylbenzamide
3-fluoro-N-[[(4S,5R)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-[(E)-prop-1-enyl]-4,5-dihydro-3H-6,1lambda6,2-benzoxathiazocin-5-yl]methyl]-N-methylbenzamide
3-fluoro-N-[[(4R,5S)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-[(E)-prop-1-enyl]-4,5-dihydro-3H-6,1lambda6,2-benzoxathiazocin-5-yl]methyl]-N-methylbenzamide
4-fluoro-N-[[(4R,5R)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-[(E)-prop-1-enyl]-4,5-dihydro-3H-6,1lambda6,2-benzoxathiazocin-5-yl]methyl]-N-methylbenzamide
2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
2-[(1R,3S,4aR,9aS)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
2-[(1R,3R,4aS,9aR)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
2-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
[(3aR,4R,9bR)-8-[2-(4-fluorophenyl)ethynyl]-5-methyl-1-(2-methylphenyl)sulfonyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-4-yl]methanol
[(1R)-7-methoxy-9-methyl-2-methylsulfonyl-1-(2-thiazolylmethyl)-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,4-piperidine]yl]methanol
3,4,5-Trihydroxy-6-[2-[6-(2-methylbut-3-en-2-yl)-7-oxo-2,3-dihydrouro[3,2-g]chromen-2-yl]propan-2-yloxy]oxane-2-carboxylic acid
3,4,5-Trihydroxy-6-[[2-(3-hydroxyphenyl)-5-methoxy-6,8-dimethyl-4-oxo-2,3-dihydrochromen-7-yl]oxy]oxane-2-carboxylic acid
alpha-L-Fucp-(1->2)-[alpha-D-Galp-(1->3)]-D-Gal-OH
7-[(2S,3S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-(2,4,5-trimethoxyphenyl)chromen-4-one
N-[4-[[4-(3-cyanobenzoyl)piperazin-1-yl]methyl]phenyl]-4-methoxybenzenesulfonamide
4-Bromobenzoylmethyl (9Z,12Z)-15,16-epoxyoctadecadienoate
4-Bromobenzoylmethyl (12Z,15Z)-9,10-epoxyoctadecadienoate
4-Bromobenzoylmethyl (9Z,15Z)-12,13-epoxyoctadecadienoate
21-hydroxypregnenolone disulfate(2-)
A 21-hydroxypregnenolone disulfate anion obtained by deprotonation of both sulfate groups of 21-hydroxypregnenolone disulfate.
IDH-305
IDH-305 is an orally available, mutant-selective and brain-penetrant IDH1 inhibitor that targets IDH1 (R132) mutation. IDH-305 exhibits greater than 200 fold selectivity for mutant IDH1 isoforms vs. WT (IC50= 27 nM (IDH1R132H), 28 nM (IDH1R132C), 6.14 μM (IDH1WT))[1][2].
PGlu-3-methyl-His-Pro-NH2 (TFA)
PGlu-3-methyl-His-Pro-NH2 TFA (A-42872 TFA), the modified thyrotropin-releasing hormone (TRH) peptide, enhances binding to pituitary TRH receptors and increases stimulation of thyroid-stimulating hormone (TSH) release from the pituitary. The in vitro permeability of PGlu-3-methyl-His-Pro-NH2 TFA through rat skin is increased in the presence of enhancers Ethanol and Cineole[1][2].
(1s,4as,6s,7r,7as)-4-formyl-7-methyl-1-{[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-6-yl (2e)-3-phenylprop-2-enoate
4-formyl-7-methyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-6-yl 3-phenylprop-2-enoate
[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-{[(3r)-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-2-benzopyran-6-yl]oxy}oxan-2-yl]methyl 4-methoxybenzoate
7-methyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4a-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-1h,7ah-cyclopenta[c]pyran-5-one
3-(3,4-dimethoxyphenyl)-6-methoxy-7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-(2,4,5-trimethoxyphenyl)chromen-4-one
4,11-dimethyl-18-(sec-butyl)-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),16,19(22)-octaene-2,9,16-triol
(3r,4s,5s,6r)-6-{[(9s)-4,5-dihydroxy-2-methyl-10-oxo-9h-anthracen-9-yl]methyl}-4,5-dihydroxyoxan-3-yl benzoate
(3s)-3-(4-hydroxyphenyl)-5-methoxy-8,8-dimethyl-6-(3-methylbut-2-en-1-yl)-3-(2-oxopropyl)pyrano[2,3-f]chromene-2,4-dione
(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (2s)-2-(4-{[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)propanoate
(3ar,4r,6as,9ar,9bs)-6a-hydroperoxy-6,9-dimethyl-3-methylidene-2-oxo-3ah,4h,7h,9ah,9bh-azuleno[4,5-b]furan-4-yl (2e)-4-hydroxy-2-({[(2e)-2-(hydroxymethyl)but-2-enoyl]oxy}methyl)but-2-enoate
[4-(hydroxymethyl)-2-(7-methoxy-2h-1,3-benzodioxol-5-yl)-5-(3,4,5-trimethoxyphenyl)oxolan-3-yl]methyl acetate
(3r,4s,5s,6r)-6-{[(9r)-4,5-dihydroxy-2-methyl-10-oxo-9h-anthracen-9-yl]methyl}-4,5-dihydroxyoxan-3-yl benzoate
(1r,4as,6s,7as)-1-[(2s,3r,4s,5s,6r)-3-{[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]-6-hydroxy-7-methylidene-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-4-carboxylic acid
4-hydroxy-3-[3-(4-hydroxyphenyl)prop-2-enoyl]-2-methoxy-5-methyl-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}benzaldehyde
(1s,4s,7s,8r,9r,10s,11r,14r)-8-(acetyloxy)-7-[(5s)-5-hydroxy-2-oxo-5h-furan-3-yl]-9-methyl-5,15-dioxo-6,16-dioxatetracyclo[8.7.0.0¹,¹⁴.0⁴,⁹]heptadec-12-en-11-yl acetate
2-(3,4-dimethoxyphenyl)-5-hydroxy-7-methoxy-3-{[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}chromen-4-one
6'-o-β-apiofuranosylsweroside
{"Ingredient_id": "HBIN012636","Ingredient_name": "6'-o-\u03b2-apiofuranosylsweroside","Alias": "NA","Ingredient_formula": "C21H30O13","Ingredient_Smile": "C=CC1C2CCOC(=O)C2=COC1OC3C(C(C(C(O3)COC4C(C(CO4)(CO)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1517","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
acetylbarlerin
{"Ingredient_id": "HBIN014453","Ingredient_name": "acetylbarlerin","Alias": "NA","Ingredient_formula": "C21H30O13","Ingredient_Smile": "CC(=O)OC1CC(C2C1C(=COC2OC3C(C(C(C(O3)CO)O)O)O)C(=O)OC)(C)OC(=O)C","Ingredient_weight": "490.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "330","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "6453480","DrugBank_id": "NA"}
bisindigotin
{"Ingredient_id": "HBIN018623","Ingredient_name": "bisindigotin","Alias": "NA","Ingredient_formula": "C32H18N4O2","Ingredient_Smile": "C1=CC=C2C(=C1)C(=C(N2)C3=NC4=CC=CC=C4C3=O)C5=C6C=CC=CC6=NC5=C7C(=O)C8=CC=CC=C8N7","Ingredient_weight": "490.5 g/mol","OB_score": "41.65719277","CAS_id": "NA","SymMap_id": "SMIT12047","TCMID_id": "NA","TCMSP_id": "MOL011100","TCM_ID_id": "NA","PubChem_id": "136861641","DrugBank_id": "NA"}