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CHEBI:173011 - 23R,24R-dimethylcholest-5,17(20)-dien-3beta-ol

ChEBI IDCHEBI:173011
ChEBI Name23R,24R-dimethylcholest-5,17(20)-dien-3beta-ol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H48O
Net Charge0
Average Mass412.702
Monoisotopic Mass412.37052
SMILES[H][C@@]12CC=C3C[C@@H](O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)/C(=C(\C)C[C@@H](C)[C@H](C)C(C)C)CC[C@@]21[H]
InChIInChI=1S/C29H48O/c1-18(2)21(5)19(3)16-20(4)25-10-11-26-24-9-8-22-17-23(30)12-14-28(22,6)27(24)13-15-29(25,26)7/h8,18-19,21,23-24,26-27,30H,9-17H2,1-7H3/b25-20+/t19-,21-,23+,24+,26+,27+,28+,29-/m1/s1
InChIKeyWSMAULFAXOAWSD-PZWGOJMFSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) brain (BTO:0000142) MetaboLights (MTBLS2457) Strain: C57BL/6J [EFO:0000606]
ChEBI Ontology
Outgoing Relation(s)
23R,24R-dimethylcholest-5,17(20)-dien-3beta-ol (CHEBI:173011) is a ergostanoid (CHEBI:50403)
IUPAC Name 
(3S,8R,9S,10R,13S,14S,17E)-10,13-dimethyl-17-[(4R,5R)-4,5,6-trimethylheptan-2-ylidene]-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-ol
Manual XrefsDatabases
LMST01031058LIPID MAPS
2300720ChemSpider
Registry NumbersSources
CAS:73731-24-5ChemIDplus