Acetoacetate

HCID 6971017CAS 141-81-1

基本情報

標準SMILES: CC(=O)CC(=O)[O-]
InChIKey: WDJHALXBUFZDSR-UHFFFAOYSA-M
分子式: C4H5O3-
平均分子量: 101.08 g/mol
単同位体質量: 101.0244176

概要

Acetoacetate is a 3-oxo monocarboxylic acid anion that is the conjugate base of acetoacetic acid, arising from deprotonation of the carboxy group. It has a role as a human metabolite. It is functionally related to a butyrate. It is a conjugate base of an acetoacetic acid.

名称と識別子

優先名称: Acetoacetate
IUPAC: 3-oxobutanoate

名称と別名

acetoacetate3-oxobutanoateoxobutyrateCHEBI:13705RefChem:914968Acetoacetate ion(1-)141-81-1Butanoic acid, 3-oxo-, ion(1-)3-oxobutanateGTPL4522CHEMBL2074691DTXSID6040955

名称をさらに表示

WDJHALXBUFZDSR-UHFFFAOYSA-MBDBM50390990c0069Q21559339