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CHEBI:172059 - Artemisia alcohol acetate

ChEBI IDCHEBI:172059
ChEBI NameArtemisia alcohol acetate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H20O2
Net Charge0
Average Mass196.290
Monoisotopic Mass196.14633
SMILESC=CC(C)(C)C(C=C(C)C)OC(C)=O
InChIInChI=1S/C12H20O2/c1-7-12(5,6)11(8-9(2)3)14-10(4)13/h7-8,11H,1H2,2-6H3
InChIKeyNGIKFWJEQGLTBM-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)
Artemisia alcohol acetate (CHEBI:172059) is a carboxylic ester (CHEBI:33308)
IUPAC Name 
3,3,6-trimethylhepta-1,5-dien-4-yl acetate
Manual XrefsDatabases
457167ChemSpider
HMDB0036048HMDB