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3-carboxy-cis,cis-muconate

Properties

Image

Occurences in reactions

MNX_ID

MNXM1134

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	6

formula

C₇H₃O₆

charge

-3

mass

182.99461

reference

InChIKey

KJOVGYUGXHIVAY-BXTBVDPRSA-K

InChI

InChI=1S/C7H6O6/c8-5(9)2-1-4(7(12)13)3-6(10)11/h1-3H,(H,8,9)(H,10,11)(H,12,13)/p-3/b2-1-,4-3+

SMILES

O=C([O-])/C=C\C(=C/C(=O)[O-])C(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:57496 chebi:57496	3-carboxy-cis,cis-muconate (1E,3Z)-buta-1,3-diene-1,2,4-tricarboxylate 3-carboxy-cis,cis-muconate trianion 3-carboxy-cis,cis-muconate(3-)
envipath:...8fd83d2a0c6e envipathM:...8fd83d2a0c6e	3-Carboxy-cis,cis-muconate
seed.compound:cpd00856 seedM:cpd00856	3-Carboxy-cis,cis-muconate (1E,3Z)-buta-1,3-diene-1,2,4-tricarboxylate 3-carboxy-cis,cis-muconate 3cmuc beta-Carboxy-cis,cis-muconate beta-carboxy-cis,cis-muconate cis,cis-Butadiene-1,2,4-tricarboxylate cis,cis-butadiene-1,2,4-tricarboxylate
sabiork.compound:5415 sabiorkM:5415 kegg.compound:C01163 keggC:C01163	3-Carboxy-cis,cis-muconate beta-Carboxy-cis,cis-muconate cis,cis-Butadiene-1,2,4-tricarboxylate
metacyc.compound:CPD-245 metacycM:CPD-245	3-carboxy-cis,cis-muconate (1E,3Z)-buta-1,3-diene-1,2,4-tricarboxylate beta-carboxy-cis,cis-muconate cis,cis-butadiene-1,2,4-tricarboxylate
CHEBI:15749 chebi:15749	3-carboxy-cis,cis-muconic acid (1E,3Z)-buta-1,3-diene-1,2,4-tricarboxylic acid 3-Carboxy-cis,cis-muconate 3-carboxy-cis,cis-muconate beta-Carboxy-cis,cis-muconate beta-carboxy-cis,cis-muconate cis,cis-Butadiene-1,2,4-tricarboxylate cis,cis-butadiene-1,2,4-tricarboxylate
bigg.metabolite:CCbuttc biggM:CCbuttc	Cis,cis-Butadiene-1,2,4-tricarboxylate
envipath:...9e80d32490f5 envipathM:...9e80d32490f5	compound 0042290
chebi:11766 chebi:11767 chebi:12801 chebi:1468 chebi:19976 biggM:M_CCbuttc keggC:M_C01163 seedM:M_cpd00856	secondary/obsolete/fantasy identifier