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deoxycholic acid

Structure via PubChem · Public domain (PubChem)

EntityQ425680· pop 20· linked from 132 articles

deoxycholic acid

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Also known as deoxycholate, 7α-deoxycholic acid, (3α,5β,12α)-3,12-dihydroxycholan-24-oic acid, Desoxycholsäure, desoxycholic acid, 3alpha,12alpha-Dihydroxy-5beta-cholanic acid

pharmaceutical drug

Chemical data

Formula
C24H40O4
Molecular weight
392.6 g/mol
IUPAC name
(4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-3,12-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
C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C
InChIKey
KXGVEGMKQFWNSR-LLQZFEROSA-N
XLogP
4.9
Polar surface area
77.8 Ų
H-bond donors
3
H-bond acceptors
4
Formal charge
0

via PubChem

Research

15,468 papers

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