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CHEBI:171788 - Citronellyl propionate

ChEBI IDCHEBI:171788
ChEBI NameCitronellyl propionate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H24O2
Net Charge0
Average Mass212.333
Monoisotopic Mass212.17763
SMILESCCC(=O)OCCC(C)CCC=C(C)C
InChIInChI=1S/C13H24O2/c1-5-13(14)15-10-9-12(4)8-6-7-11(2)3/h7,12H,5-6,8-10H2,1-4H3
InChIKeyPOPNTVRHTZDEBW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
Citronellyl propionate (CHEBI:171788) is a carboxylic ester (CHEBI:33308)
IUPAC Name 
3,7-dimethyloct-6-enyl propanoate
Manual XrefsDatabases
8502ChemSpider
HMDB0037226HMDB
LMFA07010820LIPID MAPS
Registry NumbersSources
CAS:141-14-0ChemIDplus