3alpha,12alpha-Dihydroxy-5beta-cholestan-26-oic acid

(6R)-6-[(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]-2-methylheptanoic acid

Also Known As: dihydroxycholestanoic acid|3alpha,12alpha-Dihydroxy-5beta-cholestan-26-oic acid|3alpha,12alpha-Dihydroxy-5beta-Cholestanoic Acid|(6R)-6-[(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]-2-methylheptanoic acid|(6R)-6-[(1R,3aS,3bR,5aR,7R,9aS,9bS,11S,11aR)-7,11-dihydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]-2-methylheptanoic acid

Molecular Formula	C27H46O4
Molecular Weight	434.3396 g/mol
LogP	5.5041
Topological Polar Surface Area	77.76 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	3
Rotatable Bonds	6
Exact Mass	434.3396
Monoisotopic Mass	434.3396
Heavy Atoms	31
Complexity	663.6219

Chemical Identifiers

CAS Number	73306-87-3
SMILES	C[C@H](CCCC(C)C(=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