Exact Mass: 496.1767
Exact Mass Matches: 496.1767
Found 500 metabolites which its exact mass value is equals to given mass value 496.1767
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Mycophenolic acid O-acyl-glucuronide
Mycophenolic acid O-acyl-glucuronide is a metabolite of mycophenolate mofetil. Mycophenolate mofetil (MMF) (brand names CellCept, Myfortic) is an immunosuppressant and prodrug of mycophenolic acid, used extensively in transplant medicine. It is a reversible inhibitor of inosine monophosphate dehydrogenase (IMPDH) in purine biosynthesis which is necessary for the growth of T cells and B cells. Other cells are able to recover purines via a separate, scavenger, pathway and are, thus, able to escape the effect. MMF is a less toxic alternative to azathioprine. (Wikipedia)
Oxytetracycline Dihydrate
C784 - Protein Synthesis Inhibitor > C1595 - Tetracycline Antibiotic D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents C254 - Anti-Infective Agent > C258 - Antibiotic
(R)-Isobyakangelicin 3'-glucoside
Constituent of Angelica archangelica (angelica). (R)-Isobyakangelicin 3-glucoside is found in fats and oils, herbs and spices, and green vegetables. (R)-Isobyakangelicin 3-glucoside is found in fats and oils. (R)-Isobyakangelicin 3-glucoside is a constituent of Angelica archangelica (angelica).
Cappariloside B
Constituent of the fruit of Capparis spinosa (caper). Cappariloside B is found in capers and herbs and spices. Cappariloside B is found in capers. Cappariloside B is a constituent of the fruit of Capparis spinosa (caper)
(R)-Byakangelicin 3'-glucoside
Constituent of angelica root. (R)-Byakangelicin 3-glucoside is found in fats and oils, herbs and spices, and green vegetables. (R)-Byakangelicin 3-glucoside is found in fats and oils. (R)-Byakangelicin 3-glucoside is a constituent of angelica root.
Musabalbisiane A
Musabalbisiane A is found in fruits. Musabalbisiane A is a constituent of Musa balbisiana. Constituent of Musa balbisiana. Musabalbisiane A is found in fruits.
(7R*,8R*)-3-Methoxy-3',4,7,9,9'-pentahydroxy-8,4'-oxyneolignan 4-xyloside
(7R*,8R*)-3-Methoxy-3,4,7,9,9-pentahydroxy-8,4-oxyneolignan 4-xyloside is a constituent of Pinus sylvestris (Scotch pine). Constituent of Pinus sylvestris (Scotch pine)
(R)-Byakangelicin 2'-glucoside
Constituent of angelica Angelica archangelica root. (R)-Byakangelicin 2-glucoside is found in fats and oils, herbs and spices, and green vegetables. (R)-Byakangelicin 2-glucoside is found in fats and oils. (R)-Byakangelicin 2-glucoside is a constituent of angelica Angelica archangelica root.
Mycophenolic acid glucuronide
Mycophenolic acid glucuronide is a metabolite of mycophenolate mofetil. Mycophenolate mofetil (MMF) (brand names CellCept, Myfortic) is an immunosuppressant and prodrug of mycophenolic acid, used extensively in transplant medicine. It is a reversible inhibitor of inosine monophosphate dehydrogenase (IMPDH) in purine biosynthesis which is necessary for the growth of T cells and B cells. Other cells are able to recover purines via a separate, scavenger, pathway and are, thus, able to escape the effect. MMF is a less toxic alternative to azathioprine. (Wikipedia)
N-Benzo[1,3]dioxol-5-yl-2-[5-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)-isoxazol-3-yloxy]-acetamide
Oxypaeoniflorin
Oxypaeoniflorin, an anti-oxidant, is a monoterpene glycoside compound isolated from Paeoniae species. Oxypaeoniflorin has neuroprotective and anti-inflammatory effects[1][2]. Oxypaeoniflorin, an anti-oxidant, is a monoterpene glycoside compound isolated from Paeoniae species. Oxypaeoniflorin has neuroprotective and anti-inflammatory effects[1][2].
J17.727J
Oxypaeoniflorin is a monoterpene glycoside with formula C23H28O12, isolated from several species of Paeoniae. It has a role as a plant metabolite. It is a cyclic acetal, a lactol, a bridged compound, a beta-D-glucoside, a 4-hydroxybenzoate ester and a monoterpene glycoside. Oxypaeoniflorin is a natural product found in Paeonia lactiflora and Phellodendron amurense with data available. See also: Paeonia lactiflora root (part of); Paeonia veitchii root (part of); Paeonia X suffruticosa root bark (part of). A monoterpene glycoside with formula C23H28O12, isolated from several species of Paeoniae. Oxypaeoniflorin, an anti-oxidant, is a monoterpene glycoside compound isolated from Paeoniae species. Oxypaeoniflorin has neuroprotective and anti-inflammatory effects[1][2]. Oxypaeoniflorin, an anti-oxidant, is a monoterpene glycoside compound isolated from Paeoniae species. Oxypaeoniflorin has neuroprotective and anti-inflammatory effects[1][2].
Swertiaside
Leucocyanidin 4,7-dimethylether 3-O-beta-D-glucopyranoside
(1S,4aS,7S,7aS)-7-Hydroxy-1-{[6-O-(4-hydroxybenzoyl)-β-D-glucopyranosyl]oxy}-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid
combretastatin B-1 2-beta-D-glucoside|combretastatin B-1 2-O-beta-D-glucopyranoside
2-methoxy-4-[(1S,2S)-1,2,3-trihydroxypropyl]phenyl 1-O-beta-D-[6-O-(4-hydroxybenzoyl)]glucopyranoside
punaglandin 3
3-acetoxy-1,2;8,9-diepoxy-10-hexanoyloxy-2,3,6a,7,9,10,13a,14-octahydro-1H,8H-7a,14a-cyclo-pyrazino[1,2-a;4,5-a]diindole-6,13-dione|O-acetyl-O-hexanoyl-scabrosine|Scabrosin-4-acetat-4-hexanoat
N-Acetyl-D-glucosaminyl-(1-4)-N-acetylmuramic Acid
8alpha-(2-methyl)acryloylxy-13-methoxyvernojalcanolide
2-hydroxy-4-(2-hydroxyethyl)phenyl 6-(4-hydroxy-3,5-dimethoxybenzoate) O-beta-D-glucopyranoside
4-[(4-hydroxy-4-(hydroxymethyl)-3-((4-hydroxyphenyl)ethynyl)biphenyl-2-yl)(4-hydroxyphenyl)methylene]-2,5-cyclohexadien-1-one|selaginellin
2,9,10-Triacetoxy-3-methoxy-13-(acetoxymethyl)-6,12-methano-5,6,7,12-tetrahydrodibenzo[a,d]cyclooctene
2-hydroxy-5-(2-hydroxyethyl)phenyl 6-O-(4-hydroxy-3,5-dimethoxybenzoyl)-beta-D-glucopyranoside|clemomandshuricoside A
3,10-bis-butyryloxy-1,2;8,9-diepoxy-2,3,6a,7,9,10,13a,14-octahydro-1H,8H-7a,14a-cyclo-pyrazino[1,2-a;4,5-a]diindole-6,13-dione|O,O-dibutyryl-scabrosine|Scabrosin-4,4-dibutyrat
(R,S)-4-[(4-hydroxy-4-(methyl)-3-((4-hydroxyphenyl)ethynyl)biphenyl-2-yl)(4-hydroxyphenyl)methylene]-2,5-cyclohexadien-1-one|selaginellin B
Ala Tyr Glu Asp
Glu Tyr Ala Asp
1-hydroxy-10,12-dimethoxy-8-methyl-4-(3,4,5-trihydroxy-4,6-dimethyloxan-2-yl)naphtho[1,2-c]isochromen-6-one
C24H32O11_2-Propenoic acid, 2-methyl-, (4S,6R,6aS,9R,10S,10aR)-6,10-bis(acetyloxy)-4,5,6,6a,7,8,9,10-octahydro-6a,9-dihydroxy-3-(methoxymethyl)-6,9-dimethyl-2-oxo-2H-naphtho[8a,1-b]furan-4-yl ester
C23H28O12_Cyclopenta[c]pyran-4-carboxylic acid, 6-(benzoyloxy)-1-(hexopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-5-hydroxy-7-methyl
C23H28O12_Cyclopenta[c]pyran-4-carboxylic acid, 1,4a,5,6,7,7a-hexahydro-7-hydroxy-1-[[6-O-(4-hydroxybenzoyl)-beta-D-glucopyranosyl]oxy]-7-methyl-, (1S,4aS,7S,7aS)
(1S,4aS,7S,7aS)-7-hydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[(4-hydroxybenzoyl)oxymethyl]oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylic acid
(1S,4aS,7S,7aS)-7-hydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[(4-hydroxybenzoyl)oxymethyl]oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylic acid_major
Ala Asp Glu Tyr
Ala Asp Tyr Glu
Ala Glu Asp Tyr
Ala Glu Phe Met
Ala Glu Met Phe
Ala Glu Tyr Asp
Ala Phe Glu Met
Ala Phe Met Glu
Ala Met Glu Phe
Ala Met Phe Glu
Ala Tyr Asp Glu
Cys Asp Phe Ile
Cys Asp Phe Leu
Cys Asp Ile Phe
Cys Asp Leu Phe
Cys Asp Pro Tyr
Cys Asp Tyr Pro
Cys Glu Phe Val
Cys Glu Val Phe
Cys Phe Asp Ile
Cys Phe Asp Leu
Cys Phe Glu Val
Cys Phe Ile Asp
Cys Phe Leu Asp
Cys Phe Met Pro
Cys Phe Asn Asn
Cys Phe Pro Met
Cys Phe Val Glu
Cys His His Thr
Cys His Thr His
Cys Ile Asp Phe
Cys Ile Phe Asp
Cys Ile Met Met
Cys Leu Asp Phe
Cys Leu Phe Asp
Cys Leu Met Met
Cys Met Phe Pro
Cys Met Ile Met
Cys Met Leu Met
Cys Met Met Ile
Cys Met Met Leu
Cys Met Pro Phe
Cys Asn Phe Asn
Cys Asn Asn Phe
Cys Pro Asp Tyr
Cys Pro Phe Met
Cys Pro Met Phe
Cys Pro Tyr Asp
Cys Thr His His
Cys Val Glu Phe
Cys Val Phe Glu
Cys Tyr Asp Pro
Cys Tyr Pro Asp
Asp Ala Glu Tyr
Asp Ala Tyr Glu
Asp Cys Phe Ile
Asp Cys Phe Leu
Asp Cys Ile Phe
Asp Cys Leu Phe
Asp Cys Pro Tyr
Asp Cys Tyr Pro
Asp Asp Phe Thr
Asp Asp Thr Phe
Asp Glu Ala Tyr
Asp Glu Phe Ser
Asp Glu His Pro
Asp Glu Pro His
Asp Glu Ser Phe
Asp Glu Tyr Ala
Asp Phe Cys Ile
Asp Phe Cys Leu
Asp Phe Asp Thr
Asp Phe Glu Ser
Asp Phe Ile Cys
Asp Phe Leu Cys
Asp Phe Ser Glu
Asp Phe Thr Asp
Asp His Glu Pro
Asp His Pro Glu
Asp Ile Cys Phe
Asp Met Met Thr
Asp Met Thr Met
Asp Pro Cys Tyr
Asp Pro Glu His
Asp Pro His Glu
Asp Pro Tyr Cys
Asp Ser Glu Phe
Asp Ser Phe Glu
Asp Thr Asp Phe
Asp Thr Phe Asp
Asp Thr Met Met
Asp Tyr Ala Glu
Asp Tyr Cys Pro
Asp Tyr Glu Ala
Asp Tyr Pro Cys
Glu Ala Asp Tyr
Glu Ala Tyr Asp
Glu Asp Ala Tyr
Glu Asp Phe Ser
Glu Asp His Pro
Glu Asp Pro His
Glu Asp Ser Phe
Glu Asp Tyr Ala
Glu Glu Gly Tyr
Glu Glu Tyr Gly
Glu Phe Asp Ser
Glu Phe Ser Asp
Glu Gly Glu Tyr
Glu Gly Tyr Glu
Glu His Asp Pro
Glu His Pro Asp
Glu Met Met Ser
Glu Met Ser Met
Glu Pro Asp His
Glu Pro His Asp
Glu Ser Asp Phe
Glu Ser Phe Asp
Glu Ser Met Met
Glu Tyr Asp Ala
Glu Tyr Glu Gly
Glu Tyr Gly Glu
Phe Cys Met Pro
Phe Cys Asn Asn
Phe Cys Pro Met
Phe Asp Asp Thr
Phe Asp Glu Ser
Phe Asp Ser Glu
Phe Asp Thr Asp
Phe Glu Asp Ser
Phe Glu Ser Asp
Phe Met Cys Pro
Phe Met Pro Cys
Phe Asn Cys Asn
Phe Asn Asn Cys
Phe Pro Cys Met
Phe Pro Met Cys
Phe Ser Asp Glu
Phe Ser Glu Asp
Phe Thr Asp Asp
Gly Glu Glu Tyr
Gly Glu Tyr Glu
Gly Tyr Glu Glu
His Cys His Thr
His Cys Thr His
His Asp Glu Pro
His Asp Pro Glu
His Glu Asp Pro
His Glu Pro Asp
His His Cys Thr
His His Thr Cys
His Pro Asp Glu
His Pro Glu Asp
His Thr Cys His
His Thr His Cys
Ile Cys Met Met
Ile Met Cys Met
Ile Met Met Cys
Leu Cys Met Met
Leu Met Cys Met
Leu Met Met Cys
Met Cys Phe Pro
Met Cys Ile Met
Met Cys Leu Met
Met Cys Met Ile
Met Cys Met Leu
Met Cys Pro Phe
Met Asp Met Thr
Met Asp Thr Met
Met Glu Met Ser
Met Glu Ser Met
Met Phe Cys Pro
Met Phe Pro Cys
Met Ile Cys Met
Met Ile Met Cys
Met Leu Cys Met
Met Leu Met Cys
Met Met Cys Ile
Met Met Cys Leu
Met Met Asp Thr
Met Met Glu Ser
Met Met Ile Cys
Met Met Leu Cys
Met Met Ser Glu
Met Met Thr Asp
Met Pro Cys Phe
Met Pro Phe Cys
Met Ser Glu Met
Met Ser Met Glu
Met Thr Asp Met
Met Thr Met Asp
Asn Cys Phe Asn
Asn Cys Asn Phe
Asn Phe Cys Asn
Asn Phe Asn Cys
Asn Asn Cys Phe
Asn Asn Phe Cys
Asn Asn Ser Tyr
Asn Asn Tyr Ser
Asn Ser Asn Tyr
Asn Ser Tyr Asn
Asn Tyr Asn Ser
Asn Tyr Ser Asn
Pro Cys Asp Tyr
Pro Cys Phe Met
Pro Cys Met Phe
Pro Cys Tyr Asp
Pro Asp Cys Tyr
Pro Asp Glu His
Pro Asp His Glu
Pro Asp Tyr Cys
Pro Glu Asp His
Pro Glu His Asp
Pro Phe Cys Met
Pro Phe Met Cys
Pro His Asp Glu
Pro His Glu Asp
Pro Met Cys Phe
Pro Met Phe Cys
Pro Tyr Cys Asp
Pro Tyr Asp Cys
Ser Asp Glu Phe
Ser Asp Phe Glu
Ser Glu Asp Phe
Ser Glu Phe Asp
Ser Glu Met Met
Ser Phe Asp Glu
Ser Phe Glu Asp
Ser Met Glu Met
Ser Met Met Glu
Ser Asn Asn Tyr
Ser Asn Tyr Asn
Ser Tyr Asn Asn
Thr Cys His His
Thr Asp Asp Phe
Thr Asp Phe Asp
Thr Asp Met Met
Thr Phe Asp Asp
Thr His Cys His
Thr His His Cys
Thr Met Asp Met
Thr Met Met Asp
Tyr Ala Asp Glu
Tyr Ala Glu Asp
Tyr Cys Asp Pro
Tyr Cys Pro Asp
Tyr Asp Ala Glu
Tyr Asp Cys Pro
Tyr Asp Glu Ala
Tyr Asp Pro Cys
Tyr Glu Ala Asp
Tyr Glu Asp Ala
Tyr Glu Glu Gly
Tyr Glu Gly Glu
Tyr Gly Glu Glu
Tyr Asn Asn Ser
Tyr Asn Ser Asn
Tyr Pro Cys Asp
Tyr Pro Asp Cys
Tyr Ser Asn Asn
7Z-punaglandin 3
Cappariloside B
Musabalbisiane A
(R)-Isobyakangelicin 3'-glucoside
(R)-Byakangelicin 3'-glucoside
(R)-Byakangelicin 2'-glucoside
(7R*,8R*)-3-Methoxy-3',4,7,9,9'-pentahydroxy-8,4'-oxyneolignan 4-xyloside
(R)-(+)-(Diphenylphosphino)-2-isopropoxy-1,1-binaphthyl
(S)-(+)-(Diphenylphosphino)-2-isopropoxy-1,1-binaphthyl
2,2-bis(4-methoxyphenyl)benzo[f]indeno[2,1-h]chromen-9(2H)-one
4,4-bis(4-methoxyphenyl)fluoreno[2,1-f]chromen-13(4H)-one
Benzo[3,4]fluoreno[2,1-b]pyran-13(3H)-one,3,3-bis(4-methoxyphenyl)-
Benzeneacetic acid, 3-(aminomethyl)-alpha-((hydroxy((1R)-2-methyl-1-(((3-phenylpropyl)sulfonyl)amino)propyl)phosphinyl)methyl)-, (alphaS)-
[(4S,6R,6aS,9R,10S,10aR)-6,10-diacetyloxy-6a,9-dihydroxy-3-(methoxymethyl)-6,9-dimethyl-2-oxo-5,7,8,10-tetrahydro-4H-benzo[h][1]benzofuran-4-yl] 2-methylprop-2-enoate
1-[oxo-[4-oxo-6-[(4-propan-2-ylphenyl)sulfamoyl]-1H-quinolin-3-yl]methyl]-4-piperidinecarboxamide
[3-(4-Nitrophenyl)-4-oxochromen-7-yl] 4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate
ethyl (2Z)-2-[(5Z)-5-[(2-methoxynaphthalen-1-yl)methylidene]-4-oxo-3-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]-1,3-thiazolidin-2-ylidene]acetate
(3S)-3-cyano-3-[[[(2S)-1-[(2S)-3,3-dimethyl-1-oxo-2-[[oxo-[4-(trifluoromethyl)phenyl]methyl]amino]butyl]-2-pyrrolidinyl]-oxomethyl]amino]propanoic acid
N-[(5R,6R,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-(1,3-thiazol-2-ylmethyl)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]methanesulfonamide
2-[(3S,6aR,8S,10aR)-3-hydroxy-1-[(1-methyl-4-imidazolyl)sulfonyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(3-fluorophenyl)methyl]acetamide
2-[(3R,6aS,8R,10aS)-3-hydroxy-1-[(1-methyl-4-imidazolyl)sulfonyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(3-fluorophenyl)methyl]acetamide
N-[(5R,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-(2-thiazolylmethyl)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]methanesulfonamide
N-[(5S,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-(1,3-thiazol-2-ylmethyl)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]methanesulfonamide
2-[(3S,6aR,8R,10aR)-3-hydroxy-1-[(1-methyl-4-imidazolyl)sulfonyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(3-fluorophenyl)methyl]acetamide
2-[(3S,6aS,8R,10aS)-3-hydroxy-1-[(1-methyl-4-imidazolyl)sulfonyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(3-fluorophenyl)methyl]acetamide
N-[(5S,6R,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-(2-thiazolylmethyl)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]methanesulfonamide
N-[(5R,6S,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-(2-thiazolylmethyl)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]methanesulfonamide
2-[(3R,6aS,8S,10aS)-3-hydroxy-1-[(1-methyl-4-imidazolyl)sulfonyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(3-fluorophenyl)methyl]acetamide
2-[(3R,6aR,8S,10aR)-3-hydroxy-1-[(1-methyl-4-imidazolyl)sulfonyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(3-fluorophenyl)methyl]acetamide
N-[(5S,6S,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-(2-thiazolylmethyl)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]methanesulfonamide
N-[(5R,6S,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-(2-thiazolylmethyl)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]methanesulfonamide
N-[(5S,6S,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-(2-thiazolylmethyl)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]methanesulfonamide
2-[(3R,6aR,8R,10aR)-3-hydroxy-1-[(1-methyl-4-imidazolyl)sulfonyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(3-fluorophenyl)methyl]acetamide
2-[(3S,6aS,8S,10aS)-3-hydroxy-1-[(1-methyl-4-imidazolyl)sulfonyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(3-fluorophenyl)methyl]acetamide
beta-D-Glcp3(1-carboxyEt)NAc-(1->4)-beta-D-GlcpNAc
An amino disaccharide consisting of N-acetyl-beta-D-glucosamine, substituted on O-3 with a 1-carboxyethyl group and linked (1->4) to a second N-acetyl-beta-D-glucosamine residue.
(7R*,8R*)-3-Methoxy-3,4,7,9,9-pentahydroxy-8,4-oxyneolignan 4-xyloside
19-Ethenyl-18-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-2,4,6,8,10,15-hexaen-14-one
Mycophenolic acid O-acyl-glucuronide
A carboxylic ester resulting from the formal condensation of the carboxylic acid group of mycophenolic acid with the anomeric hydroxy group of beta-D-glucuronic acid.
BMS-309403 (sodium)
BMS-309403 sodium is a potent, orally active, and selective adipocyte fatty acid binding protein (also known as FABP4, aP2) inhibitor, with Kis of <2, 250, and 350 nM for FABP4, FABP3, and FABP5, respectively. BMS-309403 sodium interacts with the fatty-acid-binding pocket within the interior of the protein and competitively inhibits the binding of endogenous fatty acids. BMS-309403 sodium improves endothelial function in apolipoprotein E-deficient mice and in cultured human endothelial cells[1][2][3].
WZ4003
WZ4003 is the first potent and highly specific NUAK kinase inhibitor with IC50 of 20 nM/100 nM for NUAK1 (ARK5)/NUAK2, without significant inhibition on other 139 kinases.
6,10-bis(acetyloxy)-6a,9-dihydroxy-3-(methoxymethyl)-6,9-dimethyl-2-oxo-4h,5h,7h,8h,10h-naphtho[4a,4-b]furan-4-yl 2-methylprop-2-enoate
9-(4,5-dihydroxy-6-methyloxan-2-yl)-1,8-dihydroxy-5,6-dimethoxy-3-methyl-5,6-dihydrotetraphene-7,12-dione
4-[(2r)-2-hydroxy-3-methyl-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butoxy]-9-methoxyfuro[3,2-g]chromen-7-one
[(1s,3r,5r,6r,8s)-6-hydroxy-8-methyl-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-9,10-dioxatetracyclo[4.3.1.0²,⁵.0³,⁸]decan-2-yl]methyl 4-hydroxybenzoate
(1s,4as,7s,7as)-7-hydroxy-7-methyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-[(4-hydroxybenzoyloxy)methyl]oxan-2-yl]oxy}-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-4-carboxylic acid
5-[12-(bromomethylidene)-4-hydroxy-3,6,9-trimethyltetracyclo[6.6.1.0²,⁶.0¹¹,¹⁵]pentadeca-7,11(15)-dien-3-yl]-2-methylpentane-1,2,3,4-tetrol
4,6,7-trihydroxy-1-[4-hydroxy-3-(2-methyl-3-phenylpropylidene)butyl]-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid
[(3r,4s,5s)-3,4,5-trihydroxy-6-[2-(1-hydroxy-4-oxocyclohexyl)ethoxy]oxan-2-yl]methyl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
methyl 5,6-bis(acetyloxy)-7-[(1e)-4-chloro-2-hydroxy-2-(octa-2,5-dien-1-yl)-5-oxocyclopent-3-en-1-ylidene]heptanoate
(4r,5r)-1,5-bis(3,4-dihydroxyphenyl)-5-hydroxy-4-{[(2s,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pentan-1-one
(1s,4as,7s,7as)-1-{[(2r,3s,4r,5r,6s)-4,5-dihydroxy-3-(4-hydroxybenzoyloxy)-6-(hydroxymethyl)oxan-2-yl]oxy}-7-hydroxy-7-methyl-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-4-carboxylic acid
4-{[4'-hydroxy-4-(hydroxymethyl)-3-[2-(4-hydroxyphenyl)ethynyl]-[1,1'-biphenyl]-2-yl](phenyl)methylidene}cyclohexa-2,5-dien-1-one
12-[(2s,3r,4r,5s)-3,4-dihydroxy-5-[(1s)-1-hydroxyethyl]oxolan-2-yl]-5-ethyl-15-hydroxy-3,17-dimethoxy-9-oxatetracyclo[8.8.0.0²,⁷.0¹¹,¹⁶]octadeca-1(10),2(7),3,5,11(16),12,14,17-octaen-8-one
2-(4-{[(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]oxy}-1h-indol-3-yl)acetonitrile
1-{[4,5-dihydroxy-3-(4-hydroxybenzoyloxy)-6-(hydroxymethyl)oxan-2-yl]oxy}-7-hydroxy-7-methyl-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-4-carboxylic acid
(4s,5r)-1,5-bis(3,4-dihydroxyphenyl)-5-hydroxy-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pentan-1-one
(1r,4ar,6r,7r,7as)-6-(3-hydroxybenzoyloxy)-7-methyl-1-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-4-carboxylic acid
(3r)-deoxypumiloside
{"Ingredient_id": "HBIN009581","Ingredient_name": "(3r)-deoxypumiloside","Alias": "NA","Ingredient_formula": "C26H28N2O8","Ingredient_Smile": "C=CC1C2CC3C4=NC5=CC=CC=C5C=C4CN3C(=O)C2=COC1OC6C(C(C(C(O6)CO)O)O)O","Ingredient_weight": "496.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5204","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "11420564","DrugBank_id": "NA"}
ampelopsisin
{"Ingredient_id": "HBIN015900","Ingredient_name": "ampelopsisin","Alias": "NA","Ingredient_formula": "C23H28O12","Ingredient_Smile": "CC(CO)C1=CC(=C(C=C1)OC2C(C(C(C(O2)COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O)O)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1079","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
angeloylpodophyllotoxin
{"Ingredient_id": "HBIN016118","Ingredient_name": "angeloylpodophyllotoxin","Alias": "NA","Ingredient_formula": "C27H28O9","Ingredient_Smile": "CC=C(C)C(=O)OC1C2COC(=O)C2C(C3=CC4=C(C=C13)OCO4)C5=CC(=C(C(=C5)OC)OC)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1232","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
aquaticoside b
{"Ingredient_id": "HBIN016535","Ingredient_name": "aquaticoside b","Alias": "NA","Ingredient_formula": "C23H28O12","Ingredient_Smile": "CC1C(CC2C1C(OC=C2C(=O)O)OC3C(C(C(C(O3)COC(=O)C4=CC=C(C=C4)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1539","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}