CHEBI:72710 - cis-dihomoaconitate(3−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name cis-dihomoaconitate(3−)
ChEBI ID CHEBI:72710
ChEBI ASCII Name cis-dihomoaconitate(3-)
Definition A tricarboxylic acid trianion obtained by deprotonation of the three carboxy groups of cis-dihomoaconitic acid; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Anne Morgat
Supplier Information
Download Molfile XML SDF
Formula C8H7O6
Net Charge -3
Average Mass 199.13760
Monoisotopic Mass 199.02591
InChI InChI=1S/C8H10O6/c9-6(10)3-1-2-5(8(13)14)4-7(11)12/h4H,1-3H2,(H,9,10)(H,11,12)(H,13,14)/p-3/b5-4-
InChIKey WXZASCSXAMHFCX-PLNGDYQASA-K
SMILES [O-]C(=O)CCC\C(=C\C([O-])=O)C([O-])=O
ChEBI Ontology
Outgoing cis-dihomoaconitate(3−) (CHEBI:72710) is a tricarboxylic acid trianion (CHEBI:27092)
cis-dihomoaconitate(3−) (CHEBI:72710) is conjugate base of cis-dihomoaconitic acid (CHEBI:72708)
Incoming cis-dihomoaconitic acid (CHEBI:72708) is conjugate acid of cis-dihomoaconitate(3−) (CHEBI:72710)
IUPAC Name
(1Z)-pent-1-ene-1,2,5-tricarboxylate
Synonyms Sources
(Z)-1,2,5-pent-1-enetricarboxylate(3−) SUBMITTER
(Z)-dihomoaconitate(3−) ChEBI
cis-(homo)2aconitate MetaCyc
cis-(homo)2aconitate UniProt
cis-(homo)2aconitate(3−) SUBMITTER
Manual Xref Database
CPD-153 MetaCyc
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Last Modified
20 August 2021