6-酮胆甾醇

Description

6-Ketocholestanol · CAS 1175-06-0 · C27H46O2. UNII 2V12D4A742.

Identification

CAS Registry Number	1175-06-0
PubChem CID	102008
Molecular formula	C27H46O2
IUPAC name	(3S,5S,8S,9S,10R,13R,14S,17R)-3-hydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one
UNII (FDA)	2V12D4A742

Computed Descriptors

Molecular Weight	402.7
XLogP3	7.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	5
Exact Mass	402.349780706
Monoisotopic Mass	402.349780706
Topological Polar Surface Area	37.3
Heavy Atom Count	29
Formal Charge	0

Physical description & handling notes

• 198.18 Ų [M+Na]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

Synonyms

6-Ketocholestanol; 1175-06-0; 6-Oxocholestanol; 5alpha-Cholestan-3beta-ol-6-one; 2V12D4A742; 5alpha-cholestan-6-oxo-3beta-ol; Cholestan-6-one, 3-hydroxy-, (3beta,5alpha)-; NSC-178278; 5alpha-Cholestan-6-one, 3beta-hydroxy-; RefChem:104888; 6-ketocholestan-3beta-ol; 214-640-5; 6-Keto Cholestanol; 5.alpha.-Cholestan-6-one, 3.beta.-hydroxy-; Cholestan-6-one, 3-hydroxy-, (3.beta.,5.alpha.)-; 3beta-Hydroxy-5alpha-cholestan-6-one

Frequently Asked Questions

What are the CAS number and molecular formula of 6-Ketocholestanol?

CAS 1175-06-0; molecular formula C27H46O2; molecular weight — g/mol.

What other names is 6-Ketocholestanol known by?

6-Ketocholestanol, 1175-06-0, 6-Oxocholestanol, 5alpha-Cholestan-3beta-ol-6-one, 2V12D4A742, 5alpha-cholestan-6-oxo-3beta-ol.

Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.