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CHEBI:133310 - 2-hydroxy-3-(2-methylidenecyclopropyl)butanedioic acid

ChEBI IDCHEBI:133310
ChEBI Name2-hydroxy-3-(2-methylidenecyclopropyl)butanedioic acid
Stars
DefinitionA 2-hydroxydicarboxylic acid that is malic acid in which one of the methylene hydrogens at position 3 has been replaced by a methylidenecyclopropyl group.
Last Modified17 February 2017
Submittermwilliams
DownloadsMolfile
FormulaC8H10O5
Net Charge0
Average Mass186.163
Monoisotopic Mass186.05282
SMILESC=C1CC1C(C(=O)O)C(O)C(=O)O
InChIInChI=1S/C8H10O5/c1-3-2-4(3)5(7(10)11)6(9)8(12)13/h4-6,9H,1-2H2,(H,10,11)(H,12,13)
InChIKeyHEWAJTLQEJUAGF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Glycine max (ncbitaxon:3847)
- MetaboLights (MTBLS118)
- MetaboLights (MTBLS117)
- PubMed (25369450)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
2-hydroxy-3-(2-methylidenecyclopropyl)butanedioic acid (CHEBI:133310) has functional parent malic acid (CHEBI:6650)
2-hydroxy-3-(2-methylidenecyclopropyl)butanedioic acid (CHEBI:133310) has role plant metabolite (CHEBI:76924)
2-hydroxy-3-(2-methylidenecyclopropyl)butanedioic acid (CHEBI:133310) is a 2-hydroxydicarboxylic acid (CHEBI:50263)
2-hydroxy-3-(2-methylidenecyclopropyl)butanedioic acid (CHEBI:133310) is a cyclopropanes (CHEBI:51454)
2-hydroxy-3-(2-methylidenecyclopropyl)butanedioic acid (CHEBI:133310) is a olefinic compound (CHEBI:78840)
IUPAC Name 
2-hydroxy-3-(2-methylidenecyclopropyl)butanedioic acid