cis,trans-4-hydroxymuconic semialdehyde(1-) (Q27125789)

(2Z,4E)-4-Hydroxy-6-oxo-2,4-hexadienoate (English)

6 October 2016

chemical formula

C₆H₅O₄⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C(=C(C(=O)O)[H])(C(=C(C=O)[H])[O-])[H]

1 reference

cis,trans-4-hydroxymuconic semialdehyde(1-) (English)

6 October 2016

isomeric SMILES

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

1 reference

cis,trans-4-hydroxymuconic semialdehyde(1-) (English)

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+

6 October 2016

Identifiers

InChI

1 reference

cis,trans-4-hydroxymuconic semialdehyde(1-) (English)

NJOJKLHNRGFVOS-REDYYMJGSA-M

6 October 2016

InChIKey

2 references

cis,trans-4-hydroxymuconic semialdehyde(1-) (English)

6 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(2Z,4E)-4-Hydroxy-6-oxo-2,4-hexadienoate (English)

6 October 2016

ChEBI ID

58434

mapping relation type

2 references

cis,trans-4-hydroxymuconic semialdehyde(1-) (English)