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CHEBI:57872 - (Z)-but-2-ene-1,2,3-tricarboxylate

ChEBI IDCHEBI:57872
ChEBI Name(Z)-but-2-ene-1,2,3-tricarboxylate
Stars
ASCII Name(Z)-but-2-ene-1,2,3-tricarboxylate
DefinitionTricarboxylate anion of (2Z)-but-2-ene-1,2,3-tricarboxylic acid; major species at pH 7.3.
Last Modified10 September 2015
DownloadsMolfile
FormulaC7H5O6
Net Charge-3
Average Mass185.111
Monoisotopic Mass185.01026
SMILESC/C(C(=O)[O-])=C(\CC(=O)[O-])C(=O)[O-]
InChIInChI=1S/C7H8O6/c1-3(6(10)11)4(7(12)13)2-5(8)9/h2H2,1H3,(H,8,9)(H,10,11)(H,12,13)/p-3/b4-3-
InChIKeyNUZLRKBHOBPTQV-ARJAWSKDSA-K
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
(Z)-but-2-ene-1,2,3-tricarboxylate (CHEBI:57872) has role human metabolite (CHEBI:77746)
(Z)-but-2-ene-1,2,3-tricarboxylate (CHEBI:57872) is a tricarboxylic acid trianion (CHEBI:27092)
(Z)-but-2-ene-1,2,3-tricarboxylate (CHEBI:57872) is conjugate base of (Z)-but-2-ene-1,2,3-tricarboxylic acid (CHEBI:16717)
Incoming Relation(s)
(Z)-but-2-ene-1,2,3-tricarboxylic acid (CHEBI:16717) is conjugate acid of (Z)-but-2-ene-1,2,3-tricarboxylate (CHEBI:57872)
IUPAC Name 
(2Z)-but-2-ene-1,2,3-tricarboxylate
Synonym  Source
(1Z)-1-methylprop-1-ene-1,2,3-tricarboxylateChEBI
UniProt Name  Source
2-methyl-cis-aconitateUniProt