601-03-6 Purity
95%
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Specification
The molecular formula of 5-Alpha-cholestan-2-beta-ol is C27H48O.
The PubChem CID of 5-Alpha-cholestan-2-beta-ol is 12724562.
The molecular weight of 5-Alpha-cholestan-2-beta-ol is 388.7 g/mol.
5-Alpha-cholestan-2-beta-ol was created in PubChem on February 8, 2007.
5-Alpha-cholestan-2-beta-ol was last modified in PubChem on November 25, 2023.
The IUPAC name of 5-Alpha-cholestan-2-beta-ol is (2R,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-2-ol.
The InChI of 5-Alpha-cholestan-2-beta-ol is InChI=1S/C27H48O/c1-18(2)7-6-8-19(3)23-13-14-24-22-12-10-20-9-11-21(28)17-27(20,5)25(22)15-16-26(23,24)4/h18-25,28H,6-17H2,1-5H3/t19-,20-,21-,22+,23-,24+,25+,26-,27+/m1/s1.
The InChIKey of 5-Alpha-cholestan-2-beta-ol is IANFNNPXOUVDGW-VBWRGJNHSA-N.
The Canonical SMILES of 5-Alpha-cholestan-2-beta-ol is CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CC(CC4)O)C)C.
5-Alpha-cholestan-2-beta-ol has 5 rotatable bonds.