(2E,4E)-2-amino-5-chloro-6-oxohexa-2,4-dienoate

Chemical Formula:

C₆H₅NO₃CL

Molecular Weight:

174.563 Daltons

Monoisotopic Mass:

175.0036207741 Daltons

SMILES:

[CH](C(=CC=C(N)C(=O)[O-])Cl)=O

InChI:

1S/C6H6ClNO3/c7-4(3-9)1-2-5(8)6(10)11/h1-3H,8H2,(H,10,11)/p-1/b4-1+,5-2+

InChIKey:

YEIFVAPTZWXPNE-GRSRPBPQSA-M

Synonyms

2-amino-5-chloromuconic semialdehyde
2-amino-5-chloromuconate 6-semialdehyde

Databases

MetaCyc: CPD-9161

MetaboLights: MTBLC75057

ChEBI: 75057

PubChem (CID): 25245565