CHEBI:171934 - Isocyclocitral

ChEBI IDCHEBI:171934
ChEBI NameIsocyclocitral
Stars
SubmitterMetaboLights
DownloadsMolfile
Formula2C10H16O
Net Charge0
Average Mass304.474
Monoisotopic Mass304.24023
SMILESCC1=CC(C)C(C)C(C=O)C1.CC1=CC(C)C(C=O)C(C)C1
InChIInChI=1S/2C10H16O/c1-7-4-8(2)9(3)10(5-7)6-11;1-7-4-8(2)10(6-11)9(3)5-7/h2*4,6,8-10H,5H2,1-3H3
InChIKeyAEXLFXYEFLKADK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
Isocyclocitral (CHEBI:171934) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
2,4,6-trimethylcyclohex-3-ene-1-carbaldehyde;3,5,6-trimethylcyclohex-3-ene-1-carbaldehyde
Manual XrefsDatabases
17332814ChemSpider
Registry NumbersSources
CAS:1335-66-6ChemIDplus