CHEBI:48946 - 2-methylbutyrate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-methylbutyrate
ChEBI ID CHEBI:48946
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C5H9O2
Net Charge -1
Average Mass 101.12376
Monoisotopic Mass 101.06080
InChI InChI=1S/C5H10O2/c1-3-4(2)5(6)7/h4H,3H2,1-2H3,(H,6,7)/p-1
InChIKey WLAMNBDJUVNPJU-UHFFFAOYSA-M
SMILES CCC(C)C([O-])=O
ChEBI Ontology
Outgoing 2-methylbutyrate (CHEBI:48946) is a branched-chain saturated fatty acid anion (CHEBI:58956)
2-methylbutyrate (CHEBI:48946) is a short-chain fatty acid anion (CHEBI:58951)
2-methylbutyrate (CHEBI:48946) is conjugate base of 2-methylbutyric acid (CHEBI:37070)
Incoming 2-methylbutyric acid (CHEBI:37070) is conjugate acid of 2-methylbutyrate (CHEBI:48946)
IUPAC Name
2-methylbutanoate
Synonym Source
2-methylbutanoate UniProt
Registry Number Type Source
4127269 Beilstein Registry Number Beilstein
Last Modified
22 May 2015