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CHEBI:193332 - Geijerone

ChEBI IDCHEBI:193332
ChEBI NameGeijerone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H18O
Net Charge0
Average Mass178.275
Monoisotopic Mass178.13577
SMILESC=C[C@@]1(C)CCC(=O)C[C@H]1C(=C)C
InChIInChI=1S/C12H18O/c1-5-12(4)7-6-10(13)8-11(12)9(2)3/h5,11H,1-2,6-8H2,3-4H3/t11-,12-/m0/s1
InChIKeyTYUCDLXRFGFSBR-RYUDHWBXSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
ChEBI Ontology
Outgoing Relation(s)
Geijerone (CHEBI:193332) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
(3S,4R)-4-ethenyl-4-methyl-3-prop-1-en-2-ylcyclohexan-1-one
Manual XrefsDatabases
165920ChemSpider
Registry NumbersSources
CAS:41411-01-2ChemIDplus