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2-methyl-trans-aconitate

PropertiesImageOccurences in reactions
MNX_IDMNXM5311Image of MNXM5311
#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 2
formulaC7H5O6
charge-3
mass185.01026
referencechebi:58915
InChIKeyNUZLRKBHOBPTQV-ONEGZZNKSA-K
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+
SMILESC/C(C(=O)[O-])=C(/CC(=O)[O-])C(=O)[O-]
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:58915
chebi:58915
2-methyl-trans-aconitate
(1E)-1-methylprop-1-ene-1,2,3-tricarboxylate
(2E)-but-2-ene-1,2,3-tricarboxylate
trans-2-methylaconitate
CHEBI:55353
chebi:55353
(2E)-but-2-ene-1,2,3-tricarboxylic acid
2-methyl-trans-aconitic acid
trans-2-methylaconitic acid
kegg.compound:C21250
keggC:C21250
2-Methyl-trans-aconitate
metacyc.compound:CPD-9421
metacycM:CPD-9421
2-methyl-trans-aconitate
2-methylaconitate
trans-2-methylaconitate
seed.compound:cpd25681
seedM:cpd25681
2-methyl-trans-aconitate
trans-2-methylaconitate
keggC:M_C21250
seedM:M_cpd25681
secondary/obsolete/fantasy identifier