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CHEBI:25331 - methyl pentanoate

ChEBI IDCHEBI:25331
ChEBI Namemethyl pentanoate
Stars
Secondary ChEBI IDCHEBI:89062
Last Modified9 February 2016
DownloadsMolfile
FormulaC6H12O2
Net Charge0
Average Mass116.160
Monoisotopic Mass116.08373
SMILESCCCCC(=O)OC
InChIInChI=1S/C6H12O2/c1-3-4-5-6(7)8-2/h3-5H2,1-2H3
InChIKeyHNBDRPTVWVGKBR-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) faeces (UBERON:0001988) PubMed (17314143)
ChEBI Ontology
Outgoing Relation(s)
methyl pentanoate (CHEBI:25331) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
methyl pentanoate
Synonyms  Source
FEMA 2752HMDB
Methyl ester of pentanoic acidHMDB
Methyl N-valerateHMDB
Methyl valerateHMDB
Methyl valerianateHMDB
N-Valeric acid methyl esterHMDB
Manual XrefsDatabases
HMDB0031207HMDB
Methyl_pentanoateWikipedia
Registry NumbersSources
CAS:624-24-8KEGG COMPOUND
Citations