7alpha,12alpha-Dihydroxy-5beta-cholestan-3-one
Molecular Formula:
C27H46O3
InChI: InChI=1/C27H46O3/c1-16(2)7-6-8-17(3)20-9-10-21-25-22(15-24(30)27(20,21)5)26(4)12-11-19(28)13-18(26)14-23(25)29/h16-18,20-25,29-30H,6-15H2,1-5H3/t17u,18u,20u,21u,22u,23-,24+,25?,26u,27u/m1/s1
InChIKey: InChIKey=HHVQPBXBALLUDF-WSSJQUJZBC
SMILES: CC(C)CCCC(C)C1CCC2C1(C(CC3C2C(CC4C3(CCC(=O)C4)C)O)O)C
Names:
C05453
(7R,12S)-7,12-dihydroxy-10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
7alpha,12alpha-Dihydroxy-5beta-cholestan-3-one
Registries:
PubChem CID 440680
PubChem ID 7815
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