compound 0229058

Properties Image MNX_ID MNXM1185509 reference envipathM:...ff48d189256d formula C10H13N2O5 global charge -1 mol weight 241.223 InChIKey IHVDMAWGZFBZRN-UHFFFAOYSA-M InChI InChI=1S/C10H14N2O5/c1-4-7(6(14)3-11-5(2)13)9(15)12-8(4)10(16)17/h6,12,14-15H,3H2,1-2H3,(H,11,13)(H,16,17)/p-1 SMILES CC(=O)NCC(O)C1=C(O)NC(C(=O)[O-])=C1C MNX internals InChI (mnx) InChI=1/C10H14N2O5/c1-4-7(6(14)3-11-5(2)13)9(15)12-8(4)10(16)17/h6,12,14-15H,3H2,1-2H3,(H,11,13)(H,16,17)/t6? SMILES (mnx) [CH3:1][C:4]1=[C:8]([C:10]([OH:16])=[O:17])[NH:12][C:9]([OH:15])=[C:7]1[CH:6]([CH2:3][N:11]=[C:5]([CH3:2])[OH:13])[OH:14]

Parent-child relations graph

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