CHEBI:89445 - Ethyl 4-methylpentanoate

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ChEBI Name Ethyl 4-methylpentanoate ChEBI ID CHEBI:89445 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C8H16O2 Net Charge 0 Average Mass 144.212 Monoisotopic Mass 144.11503 InChI InChI=1S/C8H16O2/c1-4-10-8(9)6-5-7(2)3/h7H,4-6H2,1-3H3 InChIKey OFQRUTMGVBMTFQ-UHFFFAOYSA-N SMILES CCOC(CCC(C)C)=O Metabolite of Species Details Homo sapiens (NCBI:txid9606) Found in faeces (UBERON:0001988). See: PubMed ChEBI Ontology Outgoing Ethyl 4-methylpentanoate (CHEBI:89445) is a fatty acid ester (CHEBI:35748) Synonyms Sources ethyl 4-methylpentanoate HMDB Ethyl 4-methylvalerate HMDB Ethyl isocaproate HMDB Ethyl isohexanoate HMDB Pentanoic acid, 4-methyl-, ethyl ester HMDB Valeric acid, 4-methyl-, ethyl ester HMDB Manual Xref Database HMDB0032272 HMDB View more database links Registry Number Type Source 25415-67-2 CAS Registry Number KEGG COMPOUND Citation Type Source 23454028 PubMed citation Europe PMC