CHEBI:89086 - 2-Methylpropyl 3-methylbutanoate

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ChEBI Name 2-Methylpropyl 3-methylbutanoate ChEBI ID CHEBI:89086 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 C9H18O2 Net Charge 0 Average Mass 158.238 Monoisotopic Mass 158.13068 InChI InChI=1S/C9H18O2/c1-7(2)5-9(10)11-6-8(3)4/h7-8H,5-6H2,1-4H3 InChIKey KEBDNKNVCHQIJU-UHFFFAOYSA-N SMILES CC(C)CC(=O)OCC(C)C Metabolite of Species Details Homo sapiens (NCBI:txid9606) Found in faeces (UBERON:0001988). See: PubMed ChEBI Ontology Outgoing 2-Methylpropyl 3-methylbutanoate (CHEBI:89086) is a fatty acid ester (CHEBI:35748) Synonyms Sources 2-methylpropyl 3-methylbutanoate HMDB 2-Methylpropyl 3-methylbutyrate HMDB 2-Methylpropyl isovalerate HMDB 2-Methylpropyl-3-methylbutyrate HMDB Butanoic acid, 3-methyl-, 2-methylpropyl ester HMDB FEMA 3369 HMDB Isobutyl 3-methylbutanoate HMDB Isobutyl 3-methylpropanoate HMDB Isobutyl isopentanoate HMDB Isobutyl isovalerate HMDB Isobutylisovalerate HMDB Isovaleric acid, isobutyl ester HMDB Manual Xref Database HMDB0038040 HMDB View more database links Registry Number Type Source 589-59-3 CAS Registry Number KEGG COMPOUND Citation Type Source 23454028 PubMed citation Europe PMC