Terminology Service for NFDI4Health

isobutyrate

Go to external page http://purl.obolibrary.org/obo/CHEBI_48944


A branched, short-chain, saturated fatty acid anion; the conjugate base of isobutyric acid, formed by deprotonation of the carboxylic acid group.

Term info

Label

isobutyrate

Synonyms
  • 2-methylpropanoate
database cross reference
Subsets

3_STAR

IUPAC NAME
2-methylpropanoate [ IUPAC ]

charge

-1

formula

C4H7O2

has alternative id

CHEBI:11627, CHEBI:25334

has obo namespace

chebi_ontology

has related synonym

2-methylpropionate, isobutanoate, isobutyric acid anion, iPrCO2 anion, methylpropanoate, Isobutyrat, 2-methylpropanoic acid, ion(1-), i-butyrate, 2-methylpropanoate

id

CHEBI:48944

inchi

InChI=1S/C4H8O2/c1-3(2)4(5)6/h3H,1-2H3,(H,5,6)/p-1

inchikey

KQNPFQTWMSNSAP-UHFFFAOYSA-M

mass

87.09718

monoisotopicmass

87.04515

smiles

CC(C)C([O-])=O