EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:59227 - mellitic acid hexaanion

Default Structure
ChEBI IDCHEBI:59227
ChEBI Namemellitic acid hexaanion
Stars
DefinitionThe hexacarboxylate anion of mellitic acid.
Last Modified6 May 2010
Submitterzjosephs
DownloadsMolfile
FormulaC12O12
Net Charge-6
Average Mass336.120
Monoisotopic Mass335.94227
SMILESO=C([O-])c1c(C(=O)[O-])c(C(=O)[O-])c(C(=O)[O-])c(C(=O)[O-])c1C(=O)[O-]
InChIInChI=1S/C12H6O12/c13-7(14)1-2(8(15)16)4(10(19)20)6(12(23)24)5(11(21)22)3(1)9(17)18/h(H,13,14)(H,15,16)(H,17,18)(H,19,20)(H,21,22)(H,23,24)/p-6
InChIKeyYDSWCNNOKPMOTP-UHFFFAOYSA-H
ChEBI Ontology
Outgoing Relation(s)
mellitic acid hexaanion (CHEBI:59227) is a hexacarboxylic acid anion (CHEBI:59360)
mellitic acid hexaanion (CHEBI:59227) is conjugate base of mellitic acid (CHEBI:41089)
Incoming Relation(s)
mellitic acid (CHEBI:41089) is conjugate acid of mellitic acid hexaanion (CHEBI:59227)
IUPAC Name 
benzene-1,2,3,4,5,6-hexacarboxylate
Synonyms  Source
mellitateChEBI
mellitate(6−)ChEBI
mellitic acid(6−)ChEBI
Registry NumbersSources
Gmelin:338460Gmelin
Beilstein:3919333Beilstein