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4-oxalocrotonate

Properties

Image

Occurences in reactions

MNX_ID

MNXM738769

	#reac
in my sandbox	0
in MNXref (generic)	7
in models (compartimentalized)	1

formula

C₆H₄O₅

charge

-2

mass

156.00697

reference

InChIKey

OOEDHTCVMHDXRH-HNQUOIGGSA-L

InChI

InChI=1S/C6H6O5/c7-4(6(10)11)2-1-3-5(8)9/h1,3H,2H2,(H,8,9)(H,10,11)/p-2/b3-1+

SMILES

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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
metacyc.compound:CPD-13337 metacycM:CPD-13337	4-oxalocrotonate (2E)-5-oxohex-2-enedioate (4E)-2-oxohex-4-enedioate 2-oxo-3-hexenedioate
seed.compound:cpd02183 seedM:cpd02183	4-Oxalocrotonate (2E)-5-oxohex-2-enedioate (4E)-2-oxohex-4-enedioate (Z)-5-Oxohex-2-enedioate 2-oxo-3-hexenedioate 4-oxalocrotonate gamma-Oxalocrotonate oxalc
envipath:...dc403fb3088e envipathM:...dc403fb3088e	compound 0069793
seedM:M_cpd02183	secondary/obsolete/fantasy identifier