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CHEBI:172995 - 4alpha,23,24-Trimethyl-5alpha-cholest-17(20)-en-3beta-ol

ChEBI IDCHEBI:172995
ChEBI Name4alpha,23,24-Trimethyl-5alpha-cholest-17(20)-en-3beta-ol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H52O
Net Charge0
Average Mass428.745
Monoisotopic Mass428.40182
SMILES[H][C@@]12CCC3C4CC/C(=C(/C)CC(C)C(C)C(C)C)[C@@]4(C)CCC3[C@@]1(C)CC[C@H](O)[C@H]2C
InChIInChI=1S/C30H52O/c1-18(2)21(5)19(3)17-20(4)24-11-12-26-23-9-10-25-22(6)28(31)14-16-30(25,8)27(23)13-15-29(24,26)7/h18-19,21-23,25-28,31H,9-17H2,1-8H3/b24-20+/t19?,21?,22-,23?,25-,26?,27?,28-,29+,30-/m0/s1
InChIKeyKNPKKSRQOSDIJN-UAEWGDPZSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) brain (BTO:0000142) MetaboLights (MTBLS2457) Strain: C57BL/6J [EFO:0000606]
ChEBI Ontology
Outgoing Relation(s)
4alpha,23,24-Trimethyl-5alpha-cholest-17(20)-en-3beta-ol (CHEBI:172995) is a ergostanoid (CHEBI:50403)
IUPAC Name 
(3S,4S,5S,10R,13S,17E)-4,10,13-trimethyl-17-(4,5,6-trimethylheptan-2-ylidene)-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-ol
Manual XrefsDatabases
10477923ChemSpider
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