compound 0284343

Properties Image MNX_ID MNXM1185893 reference envipathM:...dc8f2eb5d209 formula C8H7NO6 global charge -2 mol weight 213.145 InChIKey QTISWFUIJKQWLO-GRSRPBPQSA-L InChI InChI=1S/C8H9NO6/c10-6(11)1-4-5(2-7(12)13)15-8(14)3-9-4/h1-2,8-9,14H,3H2,(H,10,11)(H,12,13)/p-2/b4-1+,5-2+ SMILES O=C([O-])/C=C1/NCC(O)O/C1=C/C(=O)[O-] MNX internals InChI (mnx) InChI=1/C8H9NO6/c10-6(11)1-4-5(2-7(12)13)15-8(14)3-9-4/h1-2,8-9,14H,3H2,(H,10,11)(H,12,13)/b4-1+,5-2+/t8? SMILES (mnx) [CH:1](=[C:4]1[C:5](=[CH:2]/[C:7](=[O:12])[OH:13])\[O:15][CH:8]([OH:14])[CH2:3][NH:9]\1)\[C:6](=[O:10])[OH:11]

Parent-child relations graph

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