5-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde

Properties Image MNX_ID MNXM1368853 reference seedM:cpd02915 formula C9H10NO6 global charge -1 mol weight 228.18 InChIKey CFEAFUYPNURWCY-GDVGLLTNSA-M InChI InChI=1S/C9H11NO6/c10-6(8(13)14)3-5(4-11)1-2-7(12)9(15)16/h1-2,4-6H,3,10H2,(H,13,14)(H,15,16)/p-1/t5?,6-/m0/s1 SMILES [NH3+][C@@H](CC(C=O)C=CC(=O)C(=O)[O-])C(=O)[O-] MNX internals InChI (mnx) InChI=1/C9H11NO6/c10-6(8(13)14)3-5(4-11)1-2-7(12)9(15)16/h1-2,4-6H,3,10H2,(H,13,14)(H,15,16)/b2-1?/t5?,6-/m0/s1 SMILES (mnx) [CH:1](=[CH:2][C:7]([C:9]([OH:15])=[O:16])=[O:12])[CH:5]([CH2:3][C@@H:6]([C:8](=[O:13])[OH:14])[NH2:10])[CH:4]=[O:11]

Parent-child relations graph

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