compound 0107435

Properties Image MNX_ID MNXM1177181 reference envipathM:...b5ed22e2d4a1 formula C8H8NO7 global charge -1 mol weight 230.152 InChIKey KVBKJBGSMIRPJP-DAFODLJHSA-M InChI InChI=1S/C8H9NO7/c10-2-1-4(9-5(12)3-11)6(13)7(14)8(15)16/h1,3,6,10,13H,2H2,(H,9,12)(H,15,16)/p-1/b4-1+ SMILES O=C/C(O)=N/C(=C/CO)C(O)C(=O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C8H9NO7/c10-2-1-4(9-5(12)3-11)6(13)7(14)8(15)16/h1,3,6,10,13H,2H2,(H,9,12)(H,15,16)/b4-1+/t6? SMILES (mnx) [CH:1](\[CH2:2][OH:10])=[C:4](\[CH:6]([C:7]([C:8]([OH:15])=[O:16])=[O:14])[OH:13])[NH:9][C:5]([CH:3]=[O:11])=[O:12]

Parent-child relations graph

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