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CHEBI:212393 - (3beta,5alpha)-Cholest-8-en-3-OL

ChEBI IDCHEBI:212393
ChEBI Name(3beta,5alpha)-Cholest-8-en-3-OL
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H46O
Net Charge0
Average Mass386.664
Monoisotopic Mass386.35487
SMILESCC(C)CCC[C@@H](C)[C@H]1CCC2C3=C(CC[C@@]21C)[C@@]1(C)CC[C@H](O)C[C@@H]1CC3
InChIInChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-21,23-24,28H,6-17H2,1-5H3/t19-,20+,21+,23-,24?,26+,27-/m1/s1
InChIKeyQETLKNDKQOXZRP-PNRWUFSZSA-N
Species of MetaboliteComponentSourceComments
Nannocystis exedens (ncbitaxon:54) - DOI (10.1099/00221287-129-6-1629)
ChEBI Ontology
Outgoing Relation(s)
(3beta,5alpha)-Cholest-8-en-3-OL (CHEBI:212393) is a cholestanoid (CHEBI:50401)
IUPAC Name 
(3S,5S,10S,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol