compound 0228353

Properties Image MNX_ID MNXM1189914 reference envipathM:...96efa19b5b6f formula C10H11N2O5 global charge -1 mol weight 239.207 InChIKey LLKOQCSKTBABKJ-UHFFFAOYSA-M InChI InChI=1S/C10H12N2O5/c1-5(14)11-3-2-6-7(4-13)8(10(16)17)12-9(6)15/h4,12,15H,2-3H2,1H3,(H,11,14)(H,16,17)/p-1 SMILES CC(=O)NCCC1=C(O)NC(C(=O)[O-])=C1C=O MNX internals InChI (mnx) InChI=1/C10H12N2O5/c1-5(14)11-3-2-6-7(4-13)8(10(16)17)12-9(6)15/h4,12,15H,2-3H2,1H3,(H,11,14)(H,16,17) SMILES (mnx) [CH3:1][C:5](=[N:11][CH2:3][CH2:2][C:6]1=[C:9]([OH:15])[NH:12][C:8]([C:10]([OH:16])=[O:17])=[C:7]1[CH:4]=[O:13])[OH:14]

Parent-child relations graph

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