compound 0101526

Properties Image MNX_ID MNXM1179385 reference envipathM:...db272140b0fa formula C9H12NO8 global charge -1 mol weight 262.194 InChIKey DISAZHYZMLCRLI-UHFFFAOYSA-M InChI InChI=1S/C9H13NO8/c1-4(13)9(18,10-6(14)3-12)5(2-11)7(15)8(16)17/h3-5,11,13,18H,2H2,1H3,(H,10,14)(H,16,17)/p-1 SMILES CC(O)C(O)(/N=C(\O)C=O)C(CO)C(=O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C9H13NO8/c1-4(13)9(18,10-6(14)3-12)5(2-11)7(15)8(16)17/h3-5,11,13,18H,2H2,1H3,(H,10,14)(H,16,17)/t4?,5?,9? SMILES (mnx) [CH3:1][CH:4]([C:9]([CH:5]([CH2:2][OH:11])[C:7]([C:8]([OH:16])=[O:17])=[O:15])([NH:10][C:6]([CH:3]=[O:12])=[O:14])[OH:18])[OH:13]

Parent-child relations graph

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