CHEBI:189431 - Sodium-3-methyl-2-oxobutyrate

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ChEBI Name Sodium-3-methyl-2-oxobutyrate
ChEBI ID CHEBI:189431
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C5H7O3.Na
Net Charge 0
Average Mass 138.098
Monoisotopic Mass 138.02929
InChI InChI=1S/C5H8O3.Na/c1-3(2)4(6)5(7)8;/h3H,1-2H3,(H,7,8);/q;+1/p-1
InChIKey WIQBZDCJCRFGKA-UHFFFAOYSA-M
SMILES [Na+].O=C(C(C)C)C([O-])=O
Metabolite of Species Details
Arabidopsis thaliana (NCBI:txid3702) Found in guard cell (BTO:0000544). of strain [] See: MetaboLights Study
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Sodium-3-methyl-2-oxobutyrate (CHEBI:189431) is a oxo carboxylic acid (CHEBI:25754)
IUPAC Name
sodium;3-methyl-2-oxobutanoate
Manual Xref Database
144784 ChemSpider
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Registry Number Type Source
3715-29-5 CAS Registry Number ChemIDplus