compound 0227315

Properties Image MNX_ID MNXM1170385 reference envipathM:...e9ba298b26c9 formula C9H8NO5 global charge -1 mol weight 210.165 InChIKey UGLJVNNGBNIXON-UHFFFAOYSA-M InChI InChI=1S/C9H9NO5/c11-2-1-6-5(4-10-8(6)13)3-7(12)9(14)15/h2,4,10,13H,1,3H2,(H,14,15)/p-1 SMILES O=CCC1=C(O)NC=C1CC(=O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C9H9NO5/c11-2-1-6-5(4-10-8(6)13)3-7(12)9(14)15/h2,4,10,13H,1,3H2,(H,14,15) SMILES (mnx) [CH2:1]([CH:2]=[O:11])[C:6]1=[C:8]([OH:13])[NH:10][CH:4]=[C:5]1[CH2:3][C:7]([C:9]([OH:14])=[O:15])=[O:12]

Parent-child relations graph

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