CHEBI:89771 - Ethyl pentanoate

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ChEBI Name Ethyl pentanoate
ChEBI ID CHEBI:89771
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Formula C7H14O2
Net Charge 0
Average Mass 130.185
Monoisotopic Mass 130.099
InChI InChI=1S/C7H14O2/c1-3-5-6-7(8)9-4-2/h3-6H2,1-2H3
InChIKey ICMAFTSLXCXHRK-UHFFFAOYSA-N
SMILES CCCCC(=O)OCC
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in faeces (UBERON:0001988). See: PubMed
ChEBI Ontology
Outgoing Ethyl pentanoate (CHEBI:89771) is a fatty acid ester (CHEBI:35748)
IUPAC Name
ethyl pentanoate
Synonyms Sources
Ethyl N-valerate HMDB
Ethyl valerate HMDB
Ethyl valerianate HMDB
FEMA 2462 HMDB
N-Valeric acid ethyl ester HMDB
Pentanoic acid, ethyl ester HMDB
Valeric acid, ethyl ester HMDB
Valeric acid, ethyl ester (8CI) HMDB
Manual Xrefs Databases
Ethyl_pentanoate Wikipedia
HMDB0040297 HMDB
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Registry Number Type Source
539-82-2 CAS Registry Number KEGG COMPOUND
Citation Waiting for Citations Type Source
17314143 PubMed citation Europe PMC