3-Keto-7alpha,12alpha-dihydroxy-5alpha-cholanic acid

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Catalog Number
ACM16265240
Product Name
3-Keto-7alpha,12alpha-dihydroxy-5alpha-cholanic acid
CAS
16265-24-0
Category
Heterocyclic Organic Compound
Synonyms
3-Ketoallocholic Acid; (5α,7α,12α)-7,12-Dihydroxy-3-oxo-cholan-24-oic Acid; 5α,7α,12α-Dihydroxy-3-oxocholanic Acid;
IUPAC Name
(4S)-4-[(5S,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
Molecular Weight
406.56
Molecular Formula
C24H38O5
Canonical SMILES
CC(CCC(=O)O)C1CCC2C1(C(CC3C2C(CC4C3(CCC(=O)C4)C)O)O)C
InChI Key
OEKUSRBIIZNLHZ-PYYHIDBSSA-N
Appearance
White Solid
Exact Mass
406.27200
H-Bond Acceptor
5
H-Bond Donor
3
MSDS
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COA
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Spec Sheet
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