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CHEBI:28958 - 3-methyl-cis,cis-muconic acid

ChEBI IDCHEBI:28958
ChEBI Name3-methyl-cis,cis-muconic acid
Stars
ASCII Name3-methyl-cis,cis-muconic acid
DefinitionA dicarboxylic acid that is cis,cis-muconic acid in which the hydrogens at position 3 is substituted by a methyl group.
Secondary ChEBI IDsCHEBI:1586, CHEBI:20119
Last Modified15 February 2017
DownloadsMolfile
FormulaC7H8O4
Net Charge0
Average Mass156.137
Monoisotopic Mass156.04226
SMILESCC(/C=C\C(=O)O)=C/C(=O)O
InChIInChI=1S/C7H8O4/c1-5(4-7(10)11)2-3-6(8)9/h2-4H,1H3,(H,8,9)(H,10,11)/b3-2-,5-4-
InChIKeyLEQDZBVDPGNGMH-LDIADDGTSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3-methyl-cis,cis-muconic acid (CHEBI:28958) has functional parent cis,cis-muconic acid (CHEBI:16508)
3-methyl-cis,cis-muconic acid (CHEBI:28958) is a polyunsaturated dicarboxylic acid (CHEBI:134531)
IUPAC Name 
(2Z,4Z)-3-methylhexa-2,4-dienedioic acid
Synonyms  Source
3-methyl-cis,cis-muconic acidChEBI
(2Z,4Z)-3-methylmuconic acidChEBI
3-methyl-cis,cis-hexadienedioic acidChEBI
Manual XrefsDatabases
C04112KEGG COMPOUND
c0208UM-BBD
Registry NumbersSources
Reaxys:1723480Reaxys