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CHEBI:173005 - 24,24,26-trimethylcholest-5,25(27)-dien-3beta-ol

ChEBI IDCHEBI:173005
ChEBI Name24,24,26-trimethylcholest-5,25(27)-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)CCC(C)(C)C(=C)CC
InChIInChI=1S/C30H50O/c1-8-21(3)28(4,5)16-13-20(2)25-11-12-26-24-10-9-22-19-23(31)14-17-29(22,6)27(24)15-18-30(25,26)7/h9,20,23-27,31H,3,8,10-19H2,1-2,4-7H3/t20-,23+,24+,25-,26+,27+,29+,30-/m1/s1
InChIKeyXTQQODGMWJGROK-CMZGQUJUSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) brain (BTO:0000142) MetaboLights (MTBLS2457) Strain: C57BL/6J [EFO:0000606]
ChEBI Ontology
Outgoing Relation(s)
24,24,26-trimethylcholest-5,25(27)-dien-3beta-ol (CHEBI:173005) is a ergostanoid (CHEBI:50403)
IUPAC Name 
(3S,8S,9S,10R,13R,14S,17R)-17-[(2R)-5,5-dimethyl-6-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
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