CHEBI:15582 - (2R,3S)-2,3-dimethylmalic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (2R,3S)-2,3-dimethylmalic acid
ChEBI ID CHEBI:15582
ChEBI ASCII Name (2R,3S)-2,3-dimethylmalic acid
Definition The (2R,3S)-diastereomer of 2,3-dimethylmalic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:183, CHEBI:10857, CHEBI:18543
Supplier Information
Download Molfile XML SDF
Formula C6H10O5
Net Charge 0
Average Mass 162.14060
Monoisotopic Mass 162.05282
InChI InChI=1S/C6H10O5/c1-3(4(7)8)6(2,11)5(9)10/h3,11H,1-2H3,(H,7,8)(H,9,10)/t3-,6-/m1/s1
InChIKey WTIIULQJLZEHGZ-AWFVSMACSA-N
SMILES C[C@H](C(O)=O)[C@@](C)(O)C(O)=O
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 (2R,3S)-2,3-dimethylmalic acid (CHEBI:15582) is a 2,3-dimethylmalic acid (CHEBI:15590)
(2R,3S)-2,3-dimethylmalic acid (CHEBI:15582) is a dicarboxylic fatty acid (CHEBI:189840)
(2R,3S)-2,3-dimethylmalic acid (CHEBI:15582) is conjugate acid of (2R,3S)-2,3-dimethylmalate(2−) (CHEBI:57422)
Incoming (2R,3S)-2,3-dimethylmalate(2−) (CHEBI:57422) is conjugate base of (2R,3S)-2,3-dimethylmalic acid (CHEBI:15582)
IUPAC Name
(2R,3S)-2-hydroxy-2,3-dimethylbutanedioic acid
Synonyms Sources
(2R,3S)-2,3-dimethylmalate ChEBI
(2R,3S)-2,3-Dimethylmalate KEGG COMPOUND
Manual Xref Database
C03652 KEGG COMPOUND
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Registry Number Type Source
1725262 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
527937 PubMed citation Europe PMC
7141415 PubMed citation Europe PMC
Last Modified
24 February 2022