2-[[(3a,5a,7a,12a)-3,7,12-trihydroxy-24-oxocholan-24-yl]amino]-Ethanesulfonic acid

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Names

[ CAS No. ]:
59005-70-8

[ Name ]:
2-[[(3a,5a,7a,12a)-3,7,12-trihydroxy-24-oxocholan-24-yl]amino]-Ethanesulfonic acid

[Synonym ]:
allocholyl taurine
allocholic acid taurine-conjugate
taurocholic acid
3α,7α,12α-trihydroxy-5α-cholan-24-oyl taurine
2-[(R)-4-((3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-Trihydroxy-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-17-yl)-pentanoylamino]-ethanesulfonic acid

Chemical & Physical Properties

[ Molecular Formula ]:
C26H45NO7S

[ Molecular Weight ]:
515.70300

[ Exact Mass ]:
515.29200

[ PSA ]:
152.54000

[ LogP ]:
3.83980

Related Compounds

  • {6-[4-(Aminomethyl)phenyl]piperidin-3-yl}methanamine
  • rac-2-tert-butyl 3a-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl) (3aR,7aR)-octahydro-1H-isoindole-2,3a-dicarboxylate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 5-(ethanesulfonyl)-2-oxo-1,2-dihydropyridine-3-carboxylate
  • 1-tert-butyl 2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl) 4-fluoro-6-methyl-2,3-dihydro-1H-indole-1,2-dicarboxylate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 1-(tert-butylsulfamoyl)cyclobutane-1-carboxylate
  • 3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl) 1-methyl 4-fluoro-2-methylbenzene-1,3-dicarboxylate
  • (E)-3-(3-(3-Methoxy-3-oxopropyl)phenyl)acrylic acid
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 1,1-dioxo-2H,3H,4H-1lambda6-pyrazolo[1,5-e][1,2,5]thiadiazine-8-carboxylate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl (3S)-4-(benzyloxy)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanoate
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl (2R)-1-[(2-methyl-2H-1,2,3,4-tetrazol-5-yl)methyl]pyrrolidine-2-carboxylate
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