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CHEBI:173009 - 23,24,26-trimethylcholest-5,24(28)-dien-3beta-ol

ChEBI IDCHEBI:173009
ChEBI Name23,24,26-trimethylcholest-5,24(28)-dien-3beta-ol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H50O
Net Charge0
Average Mass426.729
Monoisotopic Mass426.38617
SMILES[H][C@@]12CC=C3C[C@@H](O)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1([H])[C@H](C)CC(C)C(=C)C(C)CC
InChIInChI=1S/C30H50O/c1-8-19(2)22(5)20(3)17-21(4)26-11-12-27-25-10-9-23-18-24(31)13-15-29(23,6)28(25)14-16-30(26,27)7/h9,19-21,24-28,31H,5,8,10-18H2,1-4,6-7H3/t19?,20?,21-,24+,25+,26-,27+,28+,29+,30-/m1/s1
InChIKeyOERZNDZNQUPHIT-ABBVIPMFSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) brain (BTO:0000142) MetaboLights (MTBLS2457) Strain: C57BL/6J [EFO:0000606]
ChEBI Ontology
Outgoing Relation(s)
23,24,26-trimethylcholest-5,24(28)-dien-3beta-ol (CHEBI:173009) has parent hydride gorgostane (CHEBI:24424)
23,24,26-trimethylcholest-5,24(28)-dien-3beta-ol (CHEBI:173009) is a steroid (CHEBI:35341)
IUPAC Name 
(3S,8S,9S,10R,13R,14S,17R)-17-[(2R)-4,6-dimethyl-5-methylideneoctan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Manual XrefsDatabases
LMST01031055LIPID MAPS
19988503ChemSpider
Registry NumbersSources
CAS:82866-33-9ChemIDplus