CHEBI:143541 - 1-methylester malic acid

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ChEBI Name 1-methylester malic acid
ChEBI ID CHEBI:143541
Definition This compound belongs to the class of organic compounds known as beta hydroxy acids and derivatives. These are compounds containing a carboxylic acid substituted with a hydroxyl group on the C3 carbon atom.
Stars This entity has been manually annotated by a third party.
Submitter Mark Williams
Supplier Information
Download Molfile XML SDF
Formula C5H8O5
Net Charge 0
Average Mass 148.114
Monoisotopic Mass 148.03717
InChI InChI=1S/C5H8O5/c1-10-5(9)3(6)2-4(7)8/h3,6H,2H2,1H3,(H,7,8)
InChIKey RTSODCRZYKSCLO-UHFFFAOYSA-N
SMILES OC(CC(O)=O)C(OC)=O
Metabolite of Species Details
Oryza sativa (NCBI:txid4530) Found in flag leaf (BTO:0002811). of strain Oryza sativa cv. N22 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 1-methylester malic acid (CHEBI:143541) is a 3-hydroxy carboxylic acid (CHEBI:61355)
1-methylester malic acid (CHEBI:143541) is a carboxylic ester (CHEBI:33308)
IUPAC Name
3-hydroxy-4-methoxy-4-oxobutanoic acid