(R)-4-((3R,5R,8S,9S,10R,13R,14S,17R,Z)-6-ethylidene-3-hydroxy-10,13-dimethyl-7-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid

HCID 86706181CAS 1516887-33-4

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Grundinformationen

Standard-SMILES: C/C=C1\C(=O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCC(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
InChIKey: RDCBMNFSJFALPG-IVDGZAPRSA-N
Summenformel: C26H40O4
Durchschnittliche Molmasse: 416,6 g/mol

Namen und Bezeichner

Bevorzugter Name: (R)-4-((3R,5R,8S,9S,10R,13R,14S,17R,Z)-6-ethylidene-3-hydroxy-10,13-dimethyl-7-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
IUPAC: (4R)-4-[(3R,5R,6Z,8S,9S,10R,13R,14S,17R)-6-ethylidene-3-hydroxy-10,13-dimethyl-7-oxo-2,3,4,5,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid

Namen und Synonyme

1516887-34-51516887-33-4(3?,?5?)?-6-Eethylidene-?3-?hydroxy-?7-?oxocholan-?24-?oic Acid(R)-4-((3R,5R,8S,9S,10R,13R,14S,17R,Z)-6-ethylidene-3-hydroxy-10,13-dimethyl-7-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acidSCHEMBL19894420RDCBMNFSJFALPG-IVDGZAPRSA-N(Z)-Obeticholic Acid Impurity 29(3|A,5|A,Z)-6-Ethylidene-3-hydroxy-7-oxocholan-24-oic acidZ-3alpha-hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic acid(E)-3I+/--hydroxy-6-ethylidene-7-keto-5I(2)-cholan-24-oic acid