CHEBI:71581 - 4α-methyl-5α-cholest-8(14)-en-3β-ol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 4α-methyl-5α-cholest-8(14)-en-3β-ol
ChEBI ID CHEBI:71581
ChEBI ASCII Name 4alpha-methyl-5alpha-cholest-8(14)-en-3beta-ol
Definition A 3β-sterol that is 5α-cholest-8(14)-en-3β-ol bearing an α-methyl substituent at position 4.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Alan Bridge
Supplier Information
Download Molfile XML SDF
Formula C28H48O
Net Charge 0
Average Mass 400.68010
Monoisotopic Mass 400.37052
InChI InChI=1S/C28H48O/c1-18(2)8-7-9-19(3)22-12-13-24-21-10-11-23-20(4)26(29)15-17-28(23,6)25(21)14-16-27(22,24)5/h18-20,22-23,25-26,29H,7-17H2,1-6H3/t19-,20+,22-,23+,25+,26+,27-,28+/m1/s1
InChIKey UIPYFONRKZTOIY-GQZGFCDBSA-N
SMILES [H][C@@]1(CCC2=C3CC[C@@]4([H])[C@H](C)[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCCC(C)C
ChEBI Ontology
Outgoing 4α-methyl-5α-cholest-8(14)-en-3β-ol (CHEBI:71581) is a 3β-sterol (CHEBI:35348)
4α-methyl-5α-cholest-8(14)-en-3β-ol (CHEBI:71581) is a cholestanoid (CHEBI:50401)
IUPAC Name
4α-methyl-5α-cholest-8(14)-en-3β-ol
Synonym Source
(3β,4α,5α)-4-methylcholest-8(14)-en-3-ol ChEBI
Registry Number Type Source
3158178 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
19531354 PubMed citation SUBMITTER
22505847 PubMed citation SUBMITTER
Last Modified
17 January 2013