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CHEBI:58853 - (2S,3S)-2-methylcitrate(3−)

ChEBI IDCHEBI:58853
ChEBI Name(2S,3S)-2-methylcitrate(3−)
Stars
ASCII Name(2S,3S)-2-methylcitrate(3-)
DefinitionTrianion arising from deprotonation of all three carboxylic acid groups of (2S,3S)-2-methylcitric acid.
Last Modified24 February 2015
DownloadsMolfile
FormulaC7H7O7
Net Charge-3
Average Mass203.126
Monoisotopic Mass203.02082
SMILESC[C@H](C(=O)[O-])[C@@](O)(CC(=O)[O-])C(=O)[O-]
InChIInChI=1S/C7H10O7/c1-3(5(10)11)7(14,6(12)13)2-4(8)9/h3,14H,2H2,1H3,(H,8,9)(H,10,11)(H,12,13)/p-3/t3-,7+/m1/s1
InChIKeyYNOXCRMFGMSKIJ-NFNCENRGSA-K
ChEBI Ontology
Outgoing Relation(s)
(2S,3S)-2-methylcitrate(3−) (CHEBI:58853) is a tricarboxylic acid trianion (CHEBI:27092)
(2S,3S)-2-methylcitrate(3−) (CHEBI:58853) is conjugate base of (2S,3S)-2-methylcitric acid (CHEBI:50948)
Incoming Relation(s)
(2S,3S)-2-methylcitric acid (CHEBI:50948) is conjugate acid of (2S,3S)-2-methylcitrate(3−) (CHEBI:58853)
IUPAC Names 
(2S,3S)-2-hydroxybutane-1,2,3-tricarboxylate
3-C-carboxylato-2,4-dideoxy-4-methyl-D-erythro-pentarate
Synonym  Source
(1S,2S)-2-hydroxy-1-methylpropane-1,2,3-tricarboxylateChEBI
UniProt Name  Source
(2S,3S)-2-methylcitrateUniProt