5α-Hydroxy-6-keto cholesterol

CAS

13027-33-3

Catalog Number

ACM13027333

Category

Steroidal Compounds

Molecular Weight

418.65

Molecular Formula

C₂₇H₄₆O₃

MSDS COA Spec Sheet

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Specification

Synonyms

CHOLESTANE-6-OXO-3,5-DIOL;CHOLESTANE-6-OXO-3BETA,5ALPHA-DIOL;CHOLESTAN-3-BETA, 5-ALPHA-DIOL-6-ONE;5ALPHA-HYDROXY-6-KETO CHOLESTEROL;5ALPHA-CHOLESTAN-3BETA,5ALPHA-DIOL-6-ONE;yakkasterone;3β,5-Dihydroxy-5α-cholestan-6-one;YS-64

IUPAC Name

(3S,5R,8S,9S,10R,13R,14S,17R)-3,5-dihydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-one

Canonical SMILES

CC(C)CCCC(C)C1CCC2C1(CCC3C2CC(=O)C4(C3(CCC(C4)O)C)O)C

InChI Key

SJZZRXMQSAXCFD-ZCBMJONGSA-N

Boiling Point

528.9ºC at 760mmHg

Flash Point

287.7ºC

Density

1.061g/cm³

Exact Mass

418.34500