compound 0104817

Properties Image MNX_ID MNXM1215699 reference envipathM:...26ecc9ab1ba4 formula C9H8NO7 global charge -1 mol weight 242.163 InChIKey PVCNDNYCRKGDPS-BCTAIJSYSA-M InChI InChI=1S/C9H9NO7/c11-2-3-5(10-1-4(12)13)7(15)9(17)8(16)6(3)14/h1,11,14-17H,2H2,(H,12,13)/p-1/b10-1+ SMILES O=C([O-])/C=N/C1=C(O)C(O)=C(O)C(O)=C1CO MNX internals InChI (mnx) InChI=1/C9H9NO7/c11-2-3-5(10-1-4(12)13)7(15)9(17)8(16)6(3)14/h1,11,14-17H,2H2,(H,12,13)/b10-1+ SMILES (mnx) [CH:1](\[C:4](=[O:12])[OH:13])=[N:10]/[C:5]1=[C:3]([CH2:2][OH:11])[C:6]([OH:14])=[C:8]([OH:16])[C:9]([OH:17])=[C:7]1[OH:15]

Parent-child relations graph

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