CHEBI:31727 - Isoamyl isovalerate

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name Isoamyl isovalerate ChEBI ID CHEBI:31727 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 C10H20O2 Net Charge 0 Average Mass 172.265 Monoisotopic Mass 172.14633 InChI InChI=1S/C10H20O2/c1-8(2)5-6-12-10(11)7-9(3)4/h8-9H,5-7H2,1-4H3 InChIKey XINCECQTMHSORG-UHFFFAOYSA-N SMILES CC(C)CCOC(=O)CC(C)C ChEBI Ontology Outgoing Isoamyl isovalerate (CHEBI:31727) is a fatty acid ester (CHEBI:35748) Synonym Source Isoamyl isovalerate KEGG COMPOUND Manual Xrefs Databases C12289 KEGG COMPOUND HMDB0030029 HMDB View more database links Registry Number Type Source 659-70-1 CAS Registry Number KEGG COMPOUND Last Modified 28 July 2014