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CHEBI:171778 - alpha-Terpineol butanoate

ChEBI IDCHEBI:171778
ChEBI Namealpha-Terpineol butanoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H24O2
Net Charge0
Average Mass224.344
Monoisotopic Mass224.17763
SMILESCCCC(=O)OC(C)(C)C1CC=C(C)CC1
InChIInChI=1S/C14H24O2/c1-5-6-13(15)16-14(3,4)12-9-7-11(2)8-10-12/h7,12H,5-6,8-10H2,1-4H3
InChIKeyLWKWNIYBQLKBMQ-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)
alpha-Terpineol butanoate (CHEBI:171778) is a p-menthane monoterpenoid (CHEBI:25186)
IUPAC Name 
2-(4-methylcyclohex-3-en-1-yl)propan-2-yl butanoate
Manual XrefsDatabases
502793ChemSpider
HMDB0032053HMDB
Registry NumbersSources
CAS:2153-28-8ChemIDplus