4,5-seco-dopa

4,5-<i>seco</i>-dopa




Chemical Formula:
C9H10NO6
Molecular Weight:
228.181 Daltons
Monoisotopic Mass:
230.066462123 Daltons
SMILES:
C(=O)C=C(CC([N+])C(=O)[O-])C=C(C([O-])=O)O
InChI:
1S/C9H11NO6/c10-6(8(13)14)3-5(1-2-11)4-7(12)9(15)16/h1-2,4,6,12H,3,10H2,(H,13,14)(H,15,16)/p-1/b5-1-,7-4+/t6-/m0/s1
InChIKey:
FNEGJFDTWWXQES-QTWONPPNSA-M

Synonyms
  • 4-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde

Databases
MetaCyc:  CPD-253
PubChem (CID):  91820361
ChEBI:  57639
KEGG:  C04796
MetaNetX:  MNXM2082