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CHEBI:89086 - 2-Methylpropyl 3-methylbutanoate

ChEBI IDCHEBI:89086
ChEBI Name2-Methylpropyl 3-methylbutanoate
Stars
DownloadsMolfile
FormulaC9H18O2
Net Charge0
Average Mass158.241
Monoisotopic Mass158.13068
SMILESCC(C)COC(=O)CC(C)C
InChIInChI=1S/C9H18O2/c1-7(2)5-9(10)11-6-8(3)4/h7-8H,5-6H2,1-4H3
InChIKeyKEBDNKNVCHQIJU-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) faeces (UBERON:0001988) PubMed (23454028)
ChEBI Ontology
Outgoing Relation(s)
2-Methylpropyl 3-methylbutanoate (CHEBI:89086) is a fatty acid ester (CHEBI:35748)
Synonyms  Source
Isobutyl 3-methylpropanoateHMDB
2-Methylpropyl-3-methylbutyrateHMDB
2-Methylpropyl isovalerateHMDB
FEMA 3369HMDB
Isobutyl 3-methylbutanoateHMDB
2-Methylpropyl 3-methylbutyrateHMDB
Manual XrefsDatabases
HMDB0038040HMDB
Registry NumbersSources
CAS:589-59-3KEGG COMPOUND
Citations