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CHEBI:184776 - Citrostediol

ChEBI IDCHEBI:184776
ChEBI NameCitrostediol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H52O2
Net Charge0
Average Mass444.744
Monoisotopic Mass444.39673
SMILESCCC(CCC(C)C1CCC2C3=CCC4C(C)C(O)CCC4(C)C3C(O)CC21C)C(C)C
InChIInChI=1S/C30H52O2/c1-8-21(18(2)3)10-9-19(4)23-13-14-25-22-11-12-24-20(5)26(31)15-16-29(24,6)28(22)27(32)17-30(23,25)7/h11,18-21,23-28,31-32H,8-10,12-17H2,1-7H3
InChIKeySMUPCTBPWWKANW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bos taurus (ncbitaxon:9913) spermatozoon (BTO:0001277) MetaboLights (MTBLS1071) Strain: Holstein [LBO:0000132]
ChEBI Ontology
Outgoing Relation(s)
Citrostediol (CHEBI:184776) has parent hydride stigmastane (CHEBI:26773)
Citrostediol (CHEBI:184776) is a steroid (CHEBI:35341)
IUPAC Name 
17-(5-ethyl-6-methylheptan-2-yl)-4,10,13-trimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,11-diol
Manual XrefsDatabases
551150ChemSpider