CHEBI:15598 - 2-methylcitrate(3−)

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ChEBI Name 2-methylcitrate(3−)
ChEBI ID CHEBI:15598
ChEBI ASCII Name 2-methylcitrate(3-)
Definition A tricarboxylic acid trianion that is the conjugate base of 2-methylcitric acid.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:19630, CHEBI:11592, CHEBI:11618, CHEBI:19695
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C7H7O7
Net Charge -3
Average Mass 203.12628
Monoisotopic Mass 203.02082
InChI InChI=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
InChIKey YNOXCRMFGMSKIJ-UHFFFAOYSA-K
SMILES CC(C([O-])=O)C(O)(CC([O-])=O)C([O-])=O
Metabolite of Species Details
Saccharomyces cerevisiae (NCBI:txid4932) Source: yeast.sf.net See: PubMed
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-methylcitrate(3−) (CHEBI:15598) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
2-methylcitrate(3−) (CHEBI:15598) has role human metabolite (CHEBI:77746)
2-methylcitrate(3−) (CHEBI:15598) is a tricarboxylic acid trianion (CHEBI:27092)
2-methylcitrate(3−) (CHEBI:15598) is conjugate base of 2-methylcitric acid (CHEBI:30835)
Incoming (2R,3S)-2-methylcitrate(3−) (CHEBI:10860) is a 2-methylcitrate(3−) (CHEBI:15598)
2-methylcitric acid (CHEBI:30835) is conjugate acid of 2-methylcitrate(3−) (CHEBI:15598)
IUPAC Name
2-hydroxybutane-1,2,3-tricarboxylate
Synonyms Sources
2-Hydroxybutane-1,2,3-tricarboxylate KEGG COMPOUND
2-methylcitrate UniProt
2-Methylcitrate KEGG COMPOUND
Manual Xref Database
C02225 KEGG COMPOUND
View more database links
Last Modified
24 August 2018