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CHEBI:231226 - (8S,9S,10R,13R,14S,17S)-17-Ethyl-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthrene

ChEBI IDCHEBI:231226
ChEBI Name(8S,9S,10R,13R,14S,17S)-17-Ethyl-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthrene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H34
Net Charge0
Average Mass286.503
Monoisotopic Mass286.26605
SMILESCCC1CCC2C3CCC4CCC=CC4(C)C3CCC12C
InChIInChI=1S/C21H34/c1-4-15-9-11-18-17-10-8-16-7-5-6-13-20(16,2)19(17)12-14-21(15,18)3/h6,13,15-19H,4-5,7-12,14H2,1-3H3
InChIKeyHOWBJCLELHJALU-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
(8S,9S,10R,13R,14S,17S)-17-Ethyl-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthrene (CHEBI:231226) has parent hydride pregnane (CHEBI:8386)
(8S,9S,10R,13R,14S,17S)-17-Ethyl-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthrene (CHEBI:231226) is a steroid (CHEBI:35341)
IUPAC Name 
17-ethyl-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthrene
Manual XrefsDatabases
HMDB0260190HMDB
14474543ChemSpider