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Obeticholic acid

 - 6-ECDCA  - INT747
Axon 3174
CAS:  459789-99-2
  • Optical Purity:  Optically pure
  • Soluble in 0.1N NaOH(aq) and DMSO
  • MF:  C26H44O4
  • MW:  420.63

Description

Obeticholic acid is a very potent and selective FXR agonist (EC50 value of 99 nM) and is shown to be endowed with anticholeretic activity in an in vivo rat model of cholestasis.

More Information

Parent CAS No. 459789-99-2
Chemical Name (4R)-4-[(3R,5S,6R,7R,8S,9S,10S,13R,14S,17R)-6-Ethyl-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
SMILES C1C[C@]2(C)C3CC[C@]4(C)[C@@H]([C@@H](CCC(=O)O)C)CCC4C3[C@H](O)[C@H](CC)[C@]2([H])C[C@@H]1O |&1:2,7,9,10,21,23,26,29,r|
MFCD N.A.
InChi InChI=1S/C26H44O4/c1-5-17-21-14-16(27)10-12-26(21,4)20-11-13-25(3)18(15(2)6-9-22(28)29)7-8-19(25)23(20)24(17)30/h15-21,23-24,27,30H,5-14H2,1-4H3,(H,28,29)/t15-,16-,17-,18-,19?,20?,21+,23?,24-,25-,26-/m1/s1
InChiKey ZXERDUOLZKYMJM-AMGBFIHRSA-N
CID 44398922
Short Description FXR agonist

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