6beta-Ethyl-7-keto-obeticholic Acid
Product Specifications
CAS Number
915038-25-4
Synonyms
(3α,5β,6β)-6-Ethyl-3-hydroxy-7-oxocholan-24-oic Acid; (3α,5β,6β)-6-Ethyl-3-hydroxy-7-oxo-cholan-24-oic Acid
Hazard Statement
No Data Available
Smiles
[H][C@@]1([C@@H]2CC)C[C@H](O)CC[C@]1(C)[C@]3([H])[C@@]([C@@](CC[C@]4([H])[C@H](C)CCC(O)=O)([H])[C@]4(C)CC3)([H])C2=O
Molecular Formula
C26H42O4
Molecular Weight
418.61
InChI
InChI=1S/C26H42O4/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/h15-21,23,27H,5-14H2,1-4H3,(H,28,29)/t15-,16-,17+,18-,19+,20+,21+,23+,25-,26-/m1/s1
Additionnal Information
IUPAC name: (R)-4-((3R,5S,6S,8S,9S,10S,13R,14S,17R)-6-ethyl-3-hydroxy-10,13-dimethyl-7-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
Shipping Conditions
Room Temperature
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