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CHEBI:89724 - Pentyl 3-methylbutanoate

ChEBI IDCHEBI:89724
ChEBI NamePentyl 3-methylbutanoate
Stars
DownloadsMolfile
FormulaC10H20O2
Net Charge0
Average Mass172.268
Monoisotopic Mass172.14633
SMILESCCCCCOC(=O)CC(C)C
InChIInChI=1S/C10H20O2/c1-4-5-6-7-12-10(11)8-9(2)3/h9H,4-8H2,1-3H3
InChIKeyQURFFFCYNQXLCU-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) faeces (UBERON:0001988) PubMed (23454028)
ChEBI Ontology
Outgoing Relation(s)
Pentyl 3-methylbutanoate (CHEBI:89724) is a fatty acid ester (CHEBI:35748)
Synonyms  Source
1-Pentyl isovalerateHMDB
Amyl isovalerateHMDB
Butanoic acid, 3-methyl-, pentyl esterHMDB
Isovaleric acid, pentyl esterHMDB
Isovaleric acid, pentyl ester (8CI)HMDB
N-Amyl isovalerateHMDB
Manual XrefsDatabases
HMDB0032045HMDB
Registry NumbersSources
CAS:25415-62-7KEGG COMPOUND
Citations