CHEBI:217203 - 3-methylbutyl heptanoate

ChEBI IDCHEBI:217203
ChEBI Name3-methylbutyl heptanoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H24O2
Net Charge0
Average Mass200.322
Monoisotopic Mass200.17763
SMILESCCCCCCC(=O)OCCC(C)C
InChIInChI=1S/C12H24O2/c1-4-5-6-7-8-12(13)14-10-9-11(2)3/h11H,4-10H2,1-3H3
InChIKeyAFCXVDRTNQNGHS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus clavatus NRRL 1 (ncbitaxon:344612) - PubMed (29765471)
ChEBI Ontology
Outgoing Relation(s)
3-methylbutyl heptanoate (CHEBI:217203) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
3-methylbutyl heptanoate
Manual XrefsDatabases
60314ChemSpider