Exact Mass: 512.1947268
Exact Mass Matches: 512.1947268
Found 500 metabolites which its exact mass value is equals to given mass value 512.1947268
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Physalin M
Physalin M belongs to the class of organic compounds known as physalins and derivatives. These are steroidal constituents of Physalis plants which possess an unusual 13,14-seco-16,24-cyclo-steroidal ring skeleton (where the bond that is normally present between the 13 and 14 positions in other steroids is broken while a new bond between positions 16 and 24 is formed). Physalin M is an extremely weak basic (essentially neutral) compound (based on its pKa). Physalin M is found in fruits. Physalin M is a constituent of Physalis alkekengi (winter cherry). Constituent of Physalis alkekengi (winter cherry). Physalin M is found in fruits.
sialosyl-Tn saccharide
1-[2-[3-[(2R,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxyprop-1-en-2-yl]-2,3-dihydro-1-benzofuran-5-yl]ethanone
(1R*,2S*,4S*,4S*,6S*,7R*,8R*,9S*,10S*,11Z,14S*,17S*)-14-acetoxy-6-chloro-4,8-epoxy-9,17-dihydroxy-2-propionyloxybriara-5(16),11-dien-18-one
6-(2,6-dihydroxy-4-methoxy-3-methyl-benzhydryl)-5,7-dihydroxy-8-methyl-2-phenyl-chroman-4-one|isomelanervin
1,2alpha-dehydro-3beta,4beta-dioxolan-daphnetoxin-21-one|genkwanin I
(2RS,3RS)-2,3,4,5-tetrahydro-3-(3-hydroxy-5-methoxyphenyl)-2-(4-hydroxy-3-methoxyphenyl)-10-methoxyphenanthro[2,1-b]furan-7-ol|phochinenin F
naphthalene-1,8-diol 1,8-bis(4-O-methyl-beta-glucopyranoside)|naphthalene-1,8-diyl bis(4-O-methyl-beta-glucopyranoside)
2,2-dimethyl-2H-(8-hydroxy-6-acetyl)-[2,3-b]-pyran-8-O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside
11-oxo-7alpha-obacunyl acetate|11-Oxo-7??-obacunyl acetate
Loperamide hydrochloride
C78276 - Agent Affecting Digestive System or Metabolism > C266 - Antidiarrheal Agent D005765 - Gastrointestinal Agents > D000930 - Antidiarrheals Loperamide (hydrochloride) (R-18553 (hydrochloride)) is an opioid receptor agonist[1][2][3]. Loperamide hydrochloride is a selective and competitive human intestinal carboxylesterases (hiCE) inhibitor. Loperamide hydrochloride has anti-diarrheal effect[4].
C24H32O12_Cyclopenta[c]pyran-4-carboxylic acid, 1-(beta-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-5,6-dihydroxy-7-methyl-, 2-(4-hydroxyphenyl)ethyl ester
C26H28N2O9_14H-Pyrano[3,4:6,7]indolizino[1,2-b]quinoline-11,14(3H)-dione, 4-ethenyl-3-(beta-D-glucopyranosyloxy)-4,4a,5,5a,6,12-hexahydro-, (3S,4R,4aS,5aS)
1-[2-[3-[(2R,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxyprop-1-en-2-yl]-2,3-dihydro-1-benzofuran-5-yl]ethanone_major
1-[2-[3-[(2R,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxyprop-1-en-2-yl]-2,3-dihydro-1-benzofuran-5-yl]ethanone_49.7\\%
1-[2-[3-[(2R,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxyprop-1-en-2-yl]-2,3-dihydro-1-benzofuran-5-yl]ethanone_88.5\\%
1-[2-[3-[(2R,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxyprop-1-en-2-yl]-2,3-dihydro-1-benzofuran-5-yl]ethanone_47.5\\%
Ala Glu Met Tyr
C22H32N4O8S (512.1940751999999)
Ala Glu Tyr Met
C22H32N4O8S (512.1940751999999)
Ala Met Glu Tyr
C22H32N4O8S (512.1940751999999)
Ala Met Tyr Glu
C22H32N4O8S (512.1940751999999)
Ala Tyr Glu Met
C22H32N4O8S (512.1940751999999)
Ala Tyr Met Glu
C22H32N4O8S (512.1940751999999)
Cys Asp Ile Tyr
C22H32N4O8S (512.1940751999999)
Cys Asp Leu Tyr
C22H32N4O8S (512.1940751999999)
Cys Asp Tyr Ile
C22H32N4O8S (512.1940751999999)
Cys Asp Tyr Leu
C22H32N4O8S (512.1940751999999)
Cys Glu Val Tyr
C22H32N4O8S (512.1940751999999)
Cys Glu Tyr Val
C22H32N4O8S (512.1940751999999)
Cys Phe Phe Pro
Cys Phe Ile Met
C23H36N4O5S2 (512.2127006000001)
Cys Phe Leu Met
C23H36N4O5S2 (512.2127006000001)
Cys Phe Met Ile
C23H36N4O5S2 (512.2127006000001)
Cys Phe Met Leu
C23H36N4O5S2 (512.2127006000001)
Cys Phe Pro Phe
Cys Ile Asp Tyr
C22H32N4O8S (512.1940751999999)
Cys Ile Phe Met
C23H36N4O5S2 (512.2127006000001)
Cys Ile Met Phe
C23H36N4O5S2 (512.2127006000001)
Cys Ile Tyr Asp
C22H32N4O8S (512.1940751999999)
Cys Leu Asp Tyr
C22H32N4O8S (512.1940751999999)
Cys Leu Phe Met
C23H36N4O5S2 (512.2127006000001)
Cys Leu Met Phe
C23H36N4O5S2 (512.2127006000001)
Cys Leu Tyr Asp
C22H32N4O8S (512.1940751999999)
Cys Met Phe Ile
C23H36N4O5S2 (512.2127006000001)
Cys Met Phe Leu
C23H36N4O5S2 (512.2127006000001)
Cys Met Ile Phe
C23H36N4O5S2 (512.2127006000001)
Cys Met Leu Phe
C23H36N4O5S2 (512.2127006000001)
Cys Met Pro Tyr
Cys Met Tyr Pro
Cys Pro Phe Phe
Cys Pro Met Tyr
Cys Pro Tyr Met
Cys Val Glu Tyr
C22H32N4O8S (512.1940751999999)
Cys Val Tyr Glu
C22H32N4O8S (512.1940751999999)
Cys Tyr Asp Ile
C22H32N4O8S (512.1940751999999)
Cys Tyr Asp Leu
C22H32N4O8S (512.1940751999999)
Cys Tyr Glu Val
C22H32N4O8S (512.1940751999999)
Cys Tyr Ile Asp
C22H32N4O8S (512.1940751999999)
Cys Tyr Leu Asp
C22H32N4O8S (512.1940751999999)
Cys Tyr Met Pro
Cys Tyr Pro Met
Cys Tyr Val Glu
C22H32N4O8S (512.1940751999999)
Asp Cys Ile Tyr
C22H32N4O8S (512.1940751999999)
Asp Cys Leu Tyr
C22H32N4O8S (512.1940751999999)
Asp Cys Tyr Ile
C22H32N4O8S (512.1940751999999)
Asp Cys Tyr Leu
C22H32N4O8S (512.1940751999999)
Asp Phe Met Thr
C22H32N4O8S (512.1940751999999)
Asp Phe Thr Met
C22H32N4O8S (512.1940751999999)
Asp His Asn Gln
Asp His Gln Asn
Asp Ile Cys Tyr
C22H32N4O8S (512.1940751999999)
Asp Ile Tyr Cys
C22H32N4O8S (512.1940751999999)
Asp Leu Cys Tyr
C22H32N4O8S (512.1940751999999)
Asp Leu Tyr Cys
C22H32N4O8S (512.1940751999999)
Asp Met Phe Thr
C22H32N4O8S (512.1940751999999)
Asp Met Thr Phe
C22H32N4O8S (512.1940751999999)
Asp Asn His Gln
Asp Asn Gln His
Asp Gln His Asn
Asp Gln Asn His
Asp Thr Phe Met
C22H32N4O8S (512.1940751999999)
Asp Thr Met Phe
C22H32N4O8S (512.1940751999999)
Asp Thr Tyr Asp
Asp Tyr Cys Ile
C22H32N4O8S (512.1940751999999)
Asp Tyr Cys Leu
C22H32N4O8S (512.1940751999999)
Asp Tyr Ile Cys
C22H32N4O8S (512.1940751999999)
Asp Tyr Leu Cys
C22H32N4O8S (512.1940751999999)
Glu Ala Met Tyr
C22H32N4O8S (512.1940751999999)
Glu Ala Tyr Met
C22H32N4O8S (512.1940751999999)
Glu Cys Val Tyr
C22H32N4O8S (512.1940751999999)
Glu Cys Tyr Val
C22H32N4O8S (512.1940751999999)
Glu Phe Met Ser
C22H32N4O8S (512.1940751999999)
Glu Phe Ser Met
C22H32N4O8S (512.1940751999999)
Glu His Met Pro
Glu His Asn Asn
Glu His Pro Met
Glu Met Ala Tyr
C22H32N4O8S (512.1940751999999)
Glu Met Phe Ser
C22H32N4O8S (512.1940751999999)
Glu Met His Pro
Glu Met Pro His
Glu Met Ser Phe
C22H32N4O8S (512.1940751999999)
Glu Met Tyr Ala
C22H32N4O8S (512.1940751999999)
Glu Asn His Asn
Glu Asn Asn His
Glu Pro His Met
Glu Pro Met His
Glu Ser Phe Met
C22H32N4O8S (512.1940751999999)
Glu Ser Met Phe
C22H32N4O8S (512.1940751999999)
Glu Thr Thr Tyr
Glu Thr Tyr Thr
Glu Val Cys Tyr
C22H32N4O8S (512.1940751999999)
Glu Val Tyr Cys
C22H32N4O8S (512.1940751999999)
Glu Tyr Ala Met
C22H32N4O8S (512.1940751999999)
Glu Tyr Cys Val
C22H32N4O8S (512.1940751999999)
Glu Tyr Met Ala
C22H32N4O8S (512.1940751999999)
Glu Tyr Thr Thr
Glu Tyr Val Cys
C22H32N4O8S (512.1940751999999)
Phe Cys Phe Pro
Phe Cys Ile Met
C23H36N4O5S2 (512.2127006000001)
Phe Cys Leu Met
C23H36N4O5S2 (512.2127006000001)
Phe Cys Met Ile
C23H36N4O5S2 (512.2127006000001)
Phe Cys Met Leu
C23H36N4O5S2 (512.2127006000001)
Phe Cys Pro Phe
Phe Asp Met Thr
C22H32N4O8S (512.1940751999999)
Phe Asp Thr Met
C22H32N4O8S (512.1940751999999)
Phe Glu Met Ser
C22H32N4O8S (512.1940751999999)
Phe Glu Ser Met
C22H32N4O8S (512.1940751999999)
Phe Phe Cys Pro
Phe Phe Pro Cys
Phe Ile Cys Met
C23H36N4O5S2 (512.2127006000001)
Phe Ile Met Cys
C23H36N4O5S2 (512.2127006000001)
Phe Leu Cys Met
C23H36N4O5S2 (512.2127006000001)
Phe Leu Met Cys
C23H36N4O5S2 (512.2127006000001)
Phe Met Cys Ile
C23H36N4O5S2 (512.2127006000001)
Phe Met Cys Leu
C23H36N4O5S2 (512.2127006000001)
Phe Met Asp Thr
C22H32N4O8S (512.1940751999999)
Phe Met Glu Ser
C22H32N4O8S (512.1940751999999)
Phe Met Ile Cys
C23H36N4O5S2 (512.2127006000001)
Phe Met Leu Cys
C23H36N4O5S2 (512.2127006000001)
Phe Met Ser Glu
C22H32N4O8S (512.1940751999999)
Phe Met Thr Asp
C22H32N4O8S (512.1940751999999)
Phe Pro Cys Phe
Phe Pro Phe Cys
Phe Ser Glu Met
C22H32N4O8S (512.1940751999999)
Phe Ser Met Glu
C22H32N4O8S (512.1940751999999)
Phe Thr Asp Met
C22H32N4O8S (512.1940751999999)
Phe Thr Met Asp
C22H32N4O8S (512.1940751999999)
Gly His His Tyr
Gly His Asn Trp
Gly His Trp Asn
Gly His Tyr His
Gly Asn His Trp
Gly Asn Trp His
Gly Trp His Asn
Gly Trp Asn His
Gly Tyr His His
His Asp Asn Gln
His Asp Gln Asn
His Glu Met Pro
His Glu Asn Asn
His Glu Pro Met
His Gly His Tyr
His Gly Asn Trp
His Gly Trp Asn
His Gly Tyr His
His His Gly Tyr
His His Tyr Gly
His Met Glu Pro
His Met Pro Glu
His Asn Asp Gln
His Asn Glu Asn
His Asn Gly Trp
His Asn Asn Glu
His Asn Gln Asp
His Asn Trp Gly
His Pro Glu Met
His Pro Met Glu
His Gln Asp Asn
His Gln Asn Asp
His Trp Gly Asn
His Trp Asn Gly
His Tyr Gly His
His Tyr His Gly
Ile Cys Asp Tyr
C22H32N4O8S (512.1940751999999)
Ile Cys Phe Met
C23H36N4O5S2 (512.2127006000001)
Ile Cys Met Phe
C23H36N4O5S2 (512.2127006000001)
Ile Cys Tyr Asp
C22H32N4O8S (512.1940751999999)
Ile Asp Cys Tyr
C22H32N4O8S (512.1940751999999)
Ile Asp Tyr Cys
C22H32N4O8S (512.1940751999999)
Ile Phe Cys Met
C23H36N4O5S2 (512.2127006000001)
Ile Phe Met Cys
C23H36N4O5S2 (512.2127006000001)
Ile Met Cys Phe
C23H36N4O5S2 (512.2127006000001)
Ile Met Phe Cys
C23H36N4O5S2 (512.2127006000001)
Ile Tyr Cys Asp
C22H32N4O8S (512.1940751999999)
Ile Tyr Asp Cys
C22H32N4O8S (512.1940751999999)
Leu Cys Asp Tyr
C22H32N4O8S (512.1940751999999)
Leu Cys Phe Met
C23H36N4O5S2 (512.2127006000001)
Leu Cys Met Phe
C23H36N4O5S2 (512.2127006000001)
Leu Cys Tyr Asp
C22H32N4O8S (512.1940751999999)
Leu Asp Cys Tyr
C22H32N4O8S (512.1940751999999)
Leu Asp Tyr Cys
C22H32N4O8S (512.1940751999999)
Leu Phe Cys Met
C23H36N4O5S2 (512.2127006000001)
Leu Phe Met Cys
C23H36N4O5S2 (512.2127006000001)
Leu Met Cys Phe
C23H36N4O5S2 (512.2127006000001)
Leu Met Phe Cys
C23H36N4O5S2 (512.2127006000001)
Leu Tyr Cys Asp
C22H32N4O8S (512.1940751999999)
Leu Tyr Asp Cys
C22H32N4O8S (512.1940751999999)
Met Ala Glu Tyr
C22H32N4O8S (512.1940751999999)
Met Ala Tyr Glu
C22H32N4O8S (512.1940751999999)
Met Cys Phe Ile
C23H36N4O5S2 (512.2127006000001)
Met Cys Phe Leu
C23H36N4O5S2 (512.2127006000001)
Met Cys Ile Phe
C23H36N4O5S2 (512.2127006000001)
Met Cys Leu Phe
C23H36N4O5S2 (512.2127006000001)
Met Cys Pro Tyr
Met Cys Tyr Pro
Met Asp Phe Thr
C22H32N4O8S (512.1940751999999)
Met Asp Thr Phe
C22H32N4O8S (512.1940751999999)
Met Glu Ala Tyr
C22H32N4O8S (512.1940751999999)
Met Glu Phe Ser
C22H32N4O8S (512.1940751999999)
Met Glu His Pro
Met Glu Pro His
Met Glu Ser Phe
C22H32N4O8S (512.1940751999999)
Met Glu Tyr Ala
C22H32N4O8S (512.1940751999999)
Met Phe Cys Ile
C23H36N4O5S2 (512.2127006000001)
Met Phe Cys Leu
C23H36N4O5S2 (512.2127006000001)
Met Phe Asp Thr
C22H32N4O8S (512.1940751999999)
Met Phe Glu Ser
C22H32N4O8S (512.1940751999999)
Met Phe Ile Cys
C23H36N4O5S2 (512.2127006000001)
Met Phe Leu Cys
C23H36N4O5S2 (512.2127006000001)
Met Phe Ser Glu
C22H32N4O8S (512.1940751999999)
Met Phe Thr Asp
C22H32N4O8S (512.1940751999999)
Met His Glu Pro
Met His Pro Glu
Met Ile Cys Phe
C23H36N4O5S2 (512.2127006000001)
Met Ile Phe Cys
C23H36N4O5S2 (512.2127006000001)
Met Leu Cys Phe
C23H36N4O5S2 (512.2127006000001)
Met Leu Phe Cys
C23H36N4O5S2 (512.2127006000001)
Met Met Met Thr
Met Met Thr Met
Met Pro Cys Tyr
Met Pro Glu His
Met Pro His Glu
Met Pro Tyr Cys
Met Ser Glu Phe
C22H32N4O8S (512.1940751999999)
Met Ser Phe Glu
C22H32N4O8S (512.1940751999999)
Met Thr Asp Phe
C22H32N4O8S (512.1940751999999)
Met Thr Phe Asp
C22H32N4O8S (512.1940751999999)
Met Thr Met Met
Met Tyr Ala Glu
C22H32N4O8S (512.1940751999999)
Met Tyr Cys Pro
Met Tyr Glu Ala
C22H32N4O8S (512.1940751999999)
Met Tyr Pro Cys
Asn Asp His Gln
Asn Asp Gln His
Asn Glu His Asn
Asn Glu Asn His
Asn Gly His Trp
Asn Gly Trp His
Asn His Asp Gln
Asn His Glu Asn
Asn His Gly Trp
Asn His Asn Glu
Asn His Gln Asp
Asn His Trp Gly
Asn Asn Glu His
Asn Asn His Glu
Asn Gln Asp His
Asn Gln His Asp
Asn Trp Gly His
Asn Trp His Gly
Pro Cys Phe Phe
Pro Cys Met Tyr
Pro Cys Tyr Met
Pro Glu His Met
Pro Glu Met His
Pro Phe Cys Phe
Pro Phe Phe Cys
Pro His Glu Met
Pro His Met Glu
Pro Met Cys Tyr
Pro Met Glu His
Pro Met His Glu
Pro Met Tyr Cys
Pro Tyr Cys Met
Pro Tyr Met Cys
Gln Asp His Asn
Gln Asp Asn His
Gln His Asp Asn
Gln His Asn Asp
Gln Asn Asp His
Gln Asn His Asp
Ser Glu Phe Met
C22H32N4O8S (512.1940751999999)
Ser Glu Met Phe
C22H32N4O8S (512.1940751999999)
Ser Glu Tyr Asp
Ser Phe Glu Met
C22H32N4O8S (512.1940751999999)
Ser Phe Met Glu
C22H32N4O8S (512.1940751999999)
Ser Met Glu Phe
C22H32N4O8S (512.1940751999999)
Ser Met Phe Glu
C22H32N4O8S (512.1940751999999)
Thr Asp Asp Tyr
Thr Asp Phe Met
C22H32N4O8S (512.1940751999999)
Thr Asp Met Phe
C22H32N4O8S (512.1940751999999)
Thr Glu Thr Tyr
Thr Glu Tyr Thr
Thr Phe Asp Met
C22H32N4O8S (512.1940751999999)
Thr Phe Met Asp
C22H32N4O8S (512.1940751999999)
Thr Met Asp Phe
C22H32N4O8S (512.1940751999999)
Thr Met Phe Asp
C22H32N4O8S (512.1940751999999)
Thr Met Met Met
Thr Thr Glu Tyr
Thr Thr Tyr Glu
Thr Tyr Glu Thr
Thr Tyr Thr Glu
Val Cys Glu Tyr
C22H32N4O8S (512.1940751999999)
Val Cys Tyr Glu
C22H32N4O8S (512.1940751999999)
Val Glu Cys Tyr
C22H32N4O8S (512.1940751999999)
Val Glu Tyr Cys
C22H32N4O8S (512.1940751999999)
Val Tyr Cys Glu
C22H32N4O8S (512.1940751999999)
Val Tyr Glu Cys
C22H32N4O8S (512.1940751999999)
Trp Gly His Asn
Trp Gly Asn His
Trp His Gly Asn
Trp His Asn Gly
Trp Asn Gly His
Trp Asn His Gly
Tyr Ala Glu Met
C22H32N4O8S (512.1940751999999)
Tyr Ala Met Glu
C22H32N4O8S (512.1940751999999)
Tyr Cys Asp Ile
C22H32N4O8S (512.1940751999999)
Tyr Cys Asp Leu
C22H32N4O8S (512.1940751999999)
Tyr Cys Glu Val
C22H32N4O8S (512.1940751999999)
Tyr Cys Ile Asp
C22H32N4O8S (512.1940751999999)
Tyr Cys Leu Asp
C22H32N4O8S (512.1940751999999)
Tyr Cys Met Pro
Tyr Cys Pro Met
Tyr Cys Val Glu
C22H32N4O8S (512.1940751999999)
Tyr Asp Cys Ile
C22H32N4O8S (512.1940751999999)
Tyr Asp Cys Leu
C22H32N4O8S (512.1940751999999)
Tyr Asp Ile Cys
C22H32N4O8S (512.1940751999999)
Tyr Asp Leu Cys
C22H32N4O8S (512.1940751999999)
Tyr Glu Ala Met
C22H32N4O8S (512.1940751999999)
Tyr Glu Cys Val
C22H32N4O8S (512.1940751999999)
Tyr Glu Met Ala
C22H32N4O8S (512.1940751999999)
Tyr Glu Thr Thr
Tyr Glu Val Cys
C22H32N4O8S (512.1940751999999)
Tyr Gly His His
Tyr His Gly His
Tyr His His Gly
Tyr Ile Cys Asp
C22H32N4O8S (512.1940751999999)
Tyr Ile Asp Cys
C22H32N4O8S (512.1940751999999)
Tyr Leu Cys Asp
C22H32N4O8S (512.1940751999999)
Tyr Leu Asp Cys
C22H32N4O8S (512.1940751999999)
Tyr Met Ala Glu
C22H32N4O8S (512.1940751999999)
Tyr Met Cys Pro
Tyr Met Glu Ala
C22H32N4O8S (512.1940751999999)
Tyr Met Pro Cys
Tyr Pro Cys Met
Tyr Pro Met Cys
Tyr Thr Glu Thr
Tyr Thr Thr Glu
Tyr Val Cys Glu
C22H32N4O8S (512.1940751999999)
Tyr Val Glu Cys
C22H32N4O8S (512.1940751999999)
10S,11R-epoxy-punaglandin 3
Physalin M
ST 26:8;O7
α-D-Galactopyranose, 2-(acetylamino)-6-O-(N-acetyl-β-neuraminosyl)-2-deoxy
Nalfurafine hydrochloride
D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids C78272 - Agent Affecting Nervous System > C67413 - Opioid Receptor Agonist
Taladegib
C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C188731 - Hedgehog Pathway Inhibitor C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor
(4bS,6aS,7S,9aS,9bS)-N-[2,5-Bis(trifluoromethyl)phenyl]-6a-methyl-2-oxo-2,4b,5,6,6a,7,8,9,9a,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinoline-7-carboxamide
C26H26F6N2O2 (512.1898368000001)
(E)-2-Methyl-4-(4-(2-Methyl-5,10-dihydro-4H-benzo[b]thieno[2,3-e][1,4]diazepin-4-yl)piperazin-1-yl)-10H-benzo[b]thieno[2,3-e][1,4]diazepine
2-Hydroxy-2-methyl-1-phenyl-propan-1-one-2,4,6-Trimethylbenzoyldiphenyl-phosphine oxide mixture
C22H21O2P.C10H12O2 (512.2116348000001)
Talmapimod
C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C2149 - Mitogen-Activated Protein Kinase Inhibitor C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C61074 - Serine/Threonine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor
3-(9-Fluoro-2-(piperidine-1-carbonyl)-1,2,3,4-tetrahydro-[1,4]diazepino[6,7,1-hi]indol-7-yl)-4-(imidazo[1,2-a]pyridin-3-yl)-1H-pyrrole-2,5-dione
C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor
N-[2-[4-(4-methoxyphenyl)-1-piperazinyl]ethyl]-6-sulfanylidene-5H-benzimidazolo[1,2-c]quinazoline-3-carboxamide
3-ethenyl-4-(9H-pyrido[3,4-b]indol-1-ylmethyl)-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylic acid
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(11),4,6,8,15-pentaene-10,14-dione
[(2R,3S,4S)-5-[4-[[(1R)-1-[(7S)-2-amino-7-methyl-4-oxo-7,8-dihydro-3H-pteridin-6-yl]ethyl]amino]phenyl]-2,3,4-trihydroxypentyl] dihydrogen phosphate
N-[3-[butyl(ethyl)amino]propyl]-2-[6-(4-morpholinylsulfonyl)-3-oxo-1,4-benzothiazin-4-yl]acetamide
C23H36N4O5S2 (512.2127006000001)
4-(10-Methyl-8-phenyl-6-phenylamino-8,11-dihydro-5,7,8,9,11a-pentaaza-cyclopenta[b]phenanthren-11-yl)-benzene-1,2-diol
[4-(3-Chlorophenyl)-1-piperazinyl]-[1-[4-(2-pyridinyl)-1-piperazinyl]-4-isoquinolinyl]methanone
C29H29ClN6O (512.2091254000001)
Glu-Thr-Thr-Tyr
A tetrapeptide composed of L-glutamic acid, two L-threonine units and L-tyrosine joined in sequence by peptide linkages.
N-acetyl-beta-neuraminyl-(2->6)-N-acetyl-alpha-D-galactosamine
An amino disaccharide composed of N-acetylneuraminic acid and N-acetyl-alpha-D-galactosamine residues linked (2->6).
5-acetamido-3,5-dideoxy-D-glycero-D-galacto-non-2-ulopyranosylonic acid-(2->6)-2-acetamido-2-deoxy-D-galacto-hexopyranose
5-acetamido-3,5-dideoxy-D-glycero-D-galacto-non-2-ulopyranosylonic acid-(2->6)-2-acetamido-2-deoxy-alpha-D-galacto-hexopyranose
(2S,4S,5R,6R)-5-Acetamido-2-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
(2S,3R,4R)-3-ethenyl-4-(9H-pyrido[3,4-b]indol-1-ylmethyl)-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylic acid
N-acetyl-alpha-neuraminyl-(2->6)-N-acetyl-alpha-D-galactosamine
An amino disaccharide composed of N-acetylneuraminic acid and 2-(acetylamino)-2-deoxy-alpha-D-galactopyranose residues in (alpha-2->6) linkage.
(1r)-2-[(3r)-3-acetyl-2,2-dimethyl-6-oxopyran-3-yl]-1-[(1r,3s,6s,7s,11s)-6-(furan-3-yl)-7,11-dimethyl-4-oxo-2,5-dioxatricyclo[5.4.0.0¹,³]undec-9-en-11-yl]ethyl acetate
n-[(2r,3s,6s,7r,8r)-7-(benzoyloxy)-8-ethyl-2,6-dimethyl-4,9-dioxo-1,5-dioxonan-3-yl]-2-hydroxy-3-[(hydroxymethylidene)amino]benzenecarboximidic acid
6,14-dihydroxy-10-oxo-4,12-bis(2-oxoheptyl)-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3,5,7,12,14-hexaene-5-carboxylic acid
(1r,3s,4s,5z,7r,8r)-3-hydroxy-5-[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-1,3-dimethyl-7-[(1e)-prop-1-en-1-yl]-8-[(5r)-2,4,5-trihydroxy-3,5-dimethyl-6-oxocyclohexa-1,3-diene-1-carbonyl]bicyclo[2.2.2]octane-2,6-dione
12-(2,3-dihydroxy-3-methylbutyl)-5,8,9-trihydroxy-7-(4-hydroxy-3-methylbut-2-en-1-yl)-2,2-dimethyl-1,11-dioxatetracen-6-one
7a,11b-dihydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-5a,8,8,11a-tetramethyl-7,12-dihydro-6h-2,5-dioxatetraphene-1,11-dione
9,10-bis(4-hydroxy-2-methoxyphenyl)-7-methyl-8,9,9a,10-tetrahydro-5bh-1,11-dioxatetraphen-2-one
5,13,17-trihydroxy-7-(2-oxoheptyl)-17-pentyl-2,10,16-trioxatetracyclo[9.8.0.0³,⁸.0¹⁴,¹⁹]nonadeca-1(19),3(8),4,6,11,13-hexaene-9,15-dione
4,6-dihydroxy-3-[(6-hydroxy-1-oxo-3-pentylisochromen-8-yl)oxy]-2-(2-oxoheptyl)benzoic acid
11-oxo-7α-obacunyl acetate
{"Ingredient_id": "HBIN000499","Ingredient_name": "11-oxo-7\u03b1-obacunyl acetate","Alias": "NA","Ingredient_formula": "C28H32O9","Ingredient_Smile": "CC(=O)OC1CC2C(OC(=O)C=CC2(C3C1(C45C(O4)C(=O)OC(C5(CC3=O)C)C6=COC=C6)C)C)(C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "16387","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6-o-(3,4-dimethoxybenzoyl)-ajugol
{"Ingredient_id": "HBIN012580","Ingredient_name": "6-o-(3,4-dimethoxybenzoyl)-ajugol","Alias": "NA","Ingredient_formula": "C24H32O12","Ingredient_Smile": "CC1(CC(C2C1C(OC=C2)OC3C(C(C(C(O3)CO)O)O)O)OC(=O)C4=CC(=C(C=C4)OC)OC)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6204","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6,7,12-trihydroxy-4,13-bis(1-hydroxyhexa-2,4-dien-1-ylidene)-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]tridec-11-ene-3,5,10-trione
(2s,3r,4r,5s,6r)-2-[(8-{[(2s,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}naphthalen-1-yl)oxy]-6-(hydroxymethyl)-5-methoxyoxane-3,4-diol
(1s,18s,19r,20s)-19-ethenyl-18-{[(2r,3s,4r,5r,6s)-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(11),4,6,8,15-pentaene-10,14-dione
(7s)-5-chloro-3-(2-hydroxy-6-methylphenyl)-7-methyl-6,8-dioxoisochromen-7-yl (2e)-2,4-dimethyldec-2-enoate
C29H33ClO6 (512.1965548000001)
1-(8-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-2,2-dimethylchromen-6-yl)ethanone
2-[(1s,9r,12r)-5-hydroxy-12-(5-hydroxy-2,2-dimethylchromene-6-carbonyl)-9-methyl-8-oxatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-11-yl]benzene-1,3-diol
[(2r,3s,4s,5r,6s)-6-{[(1s,4ar,5r,7s,7as)-5,7-dihydroxy-7-methyl-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl 3,4-dimethoxybenzoate
2-(3-acetyl-2,2-dimethyl-6-oxopyran-3-yl)-1-[6-(furan-3-yl)-7,11-dimethyl-4-oxo-2,5-dioxatricyclo[5.4.0.0¹,³]undec-9-en-11-yl]ethyl acetate
(4s,5r,6s)-5-ethenyl-4-{9h-pyrido[3,4-b]indol-1-ylmethyl}-6-{[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,6-dihydro-4h-pyran-3-carboxylic acid
(1s,4ar,5r,7s,7as)-7-hydroxy-7-methyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-5-yl 3,4-dimethoxybenzoate
4,4'-dihydroxy-6-[2-(2-methoxyphenyl)ethyl]-3,3'-dimethyl-6'-(2-phenylethyl)-[1,1'-bi(cyclohexane)]-1(6),1'(6'),3,3'-tetraene-2,2',5,5'-tetrone
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(11),4,6,8,15-pentaene-10,14-dione
4,13-bis(hexa-2,4-dienoyl)-3,6,7,10,12-pentahydroxy-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]trideca-3,10,12-trien-5-one
3-{[3-carboxy-5-(hexa-1,3-dien-1-yl)-5-methyl-4-oxofuran-2-yl]methyl}-11-hydroxy-7,8,10-trimethyl-2,6-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(13),9,11-triene-12-carboxylic acid
2-[(1r,9s,12r)-5-hydroxy-12-(5-hydroxy-2,2-dimethylchromene-6-carbonyl)-9-methyl-8-oxatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-11-yl]benzene-1,3-diol
15-(2,2-dimethyl-5-oxooxolan-3-yl)-8,15-dimethyl-2-methylidene-12-oxo-7-(2-oxo-5h-furan-3-yl)-4,11-dioxatetracyclo[8.5.0.0³,⁵.0³,⁸]pentadec-13-en-9-yl acetate
(2s)-6-[(s)-(2,6-dihydroxy-4-methoxy-3-methylphenyl)(phenyl)methyl]-5,7-dihydroxy-8-methyl-2-phenyl-2,3-dihydro-1-benzopyran-4-one
19-ethenyl-16-hydroxy-18-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-1(21),2(10),4,6,8,15-hexaen-14-one
17-ethenyl-18-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-19-oxa-2,12-diazapentacyclo[14.3.1.0²,¹⁴.0⁵,¹³.0⁶,¹¹]icosa-3,5,7,9,11,13-hexaene-20-carboxylic acid
(1s,2s,3r,5r,6r,14r,15s,18r,21s,22r,25s)-5,18-dihydroxy-1,14,21,25-tetramethyl-4,20,23-trioxaheptacyclo[20.3.1.1²,⁵.0³,¹⁸.0³,²¹.0⁶,¹⁵.0⁹,¹⁴]heptacosa-8,10-diene-13,19,24,27-tetrone
12-[(2s)-2,3-dihydroxy-3-methylbutyl]-5,8,9-trihydroxy-7-[(2z)-4-hydroxy-3-methylbut-2-en-1-yl]-2,2-dimethyl-1,11-dioxatetracen-6-one
(2s,3s)-2-(4-hydroxy-3-methoxyphenyl)-3-(3-hydroxy-5-methoxyphenyl)-10-methoxy-2h,3h,4h,5h-phenanthro[2,1-b]furan-7-ol
(1r,3s,5r,7r,8r,9r,10r,15r)-15-[(3r)-2,2-dimethyl-5-oxooxolan-3-yl]-8,15-dimethyl-2-methylidene-12-oxo-7-(2-oxo-5h-furan-3-yl)-4,11-dioxatetracyclo[8.5.0.0³,⁵.0³,⁸]pentadec-13-en-9-yl acetate
5-ethenyl-4-{9h-pyrido[3,4-b]indol-1-ylmethyl}-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,6-dihydro-4h-pyran-3-carboxylic acid
(1r,2r,4s,7s,8s,10s,12r)-7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,15,20-trioxo-3,6,16-trioxapentacyclo[9.9.0.0²,⁴.0²,⁸.0¹²,¹⁸]icos-13-en-10-yl acetate
(1s,18r,19r)-19-ethenyl-16-hydroxy-18-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-2(10),4,6,8,15,20-hexaen-14-one
(1r,2s,4s,5s,9s,10s,11r,13s,14s,15r,17r,19r,21r)-10-hydroxy-11-(hydroxymethyl)-4,21-dimethyl-17-phenyl-19-(prop-1-en-2-yl)-6,8,12,16,18,22-hexaoxaheptacyclo[15.4.1.0¹,¹⁴.0²,⁹.0⁵,⁹.0¹¹,¹³.0¹⁵,¹⁹]docosan-7-one
10-hydroxy-11-(hydroxymethyl)-4,21-dimethyl-17-phenyl-19-(prop-1-en-2-yl)-6,8,12,16,18,22-hexaoxaheptacyclo[15.4.1.0¹,¹⁴.0²,⁹.0⁵,⁹.0¹¹,¹³.0¹⁵,¹⁹]docosan-7-one
n-[(2r,3s,6s,7r,8r)-7-(acetyloxy)-8-benzyl-2,6-dimethyl-4,9-dioxo-1,5-dioxonan-3-yl]-2-hydroxy-3-[(hydroxymethylidene)amino]benzenecarboximidic acid
5-chloro-3-(2-hydroxy-6-methylphenyl)-7-methyl-6,8-dioxoisochromen-7-yl 2,4-dimethyldec-2-enoate
C29H33ClO6 (512.1965548000001)