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cis,trans-4-hydroxymuconate semialdehyde

Properties

Image

Occurences in reactions

MNX_ID

MNXM2992

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₆H₅O₄

charge

-1

mass

141.1015

reference

InChIKey

NJOJKLHNRGFVOS-REDYYMJGSA-M

InChI

InChI=1S/C6H6O4/c7-4-3-5(8)1-2-6(9)10/h1-4,8H,(H,9,10)/p-1/b2-1-,5-3+

SMILES

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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58434 chebi:58434	cis,trans-4-hydroxymuconate semialdehyde (2Z,4E)-4-hydroxy-6-oxohexa-2,4-dienoate (2Z,4E)-4-hydroxymuconic semialdehyde(1-)
metacyc.compound:CPD-18635 metacycM:CPD-18635	(2Z,4E)-4-hydroxy-6-oxohexa-2,4-dienoate 4-hydroxymuconic semialdehyde (ambiguous) cis,trans-4-hydroxymuconic semialdehyde
CHEBI:18301 chebi:18301	(2Z,4E)-4-hydroxymuconic semialdehyde (2Z,4E)-4-hydroxy-6-oxohexa-2,4-dienoic acid cis,cis-4-hydroxymuconic semialdehyde
seed.compound:cpd04007 seedM:cpd04007	4-Hydroxymuconic semialdehyde (2E,4Z)-4-hydroxy-6-oxohexa-2,4-dienoate (2Z,4E)-4-hydroxy-6-oxohexa-2,4-dienoate 4-hydroxymuconic semialdehyde 4-hydroxymuconic semialdehyde (ambiguous) cis,cis-4-Hydroxymuconic semialdehyde cis,trans-4-Hydroxymuconic semialdehyde cis,trans-4-hydroxymuconic semialdehyde
envipath:...7444bf09851d envipathM:...7444bf09851d	cis,cis-4-Hydroxymuconic semialdehyde
kegg.compound:C06603 keggC:C06603	cis,cis-4-Hydroxymuconic semialdehyde 4-Hydroxymuconic semialdehyde
chebi:10452 chebi:12011 chebi:23261 keggC:M_C06603 seedM:M_cpd04007	secondary/obsolete/fantasy identifier