compound 0074879

Properties Image MNX_ID MNXM1191795 reference envipathM:...e7d4322eaf86 formula C10H8NO7 global charge -1 mol weight 254.174 InChIKey UXLAVNMSNAOFNR-UHFFFAOYSA-M InChI InChI=1S/C10H9NO7/c12-3-11-5-2-1-4(6(13)8(5)15)7(14)9(16)10(17)18/h1-2,7,9,13-16H,(H,17,18)/p-1 SMILES O=C=NC1=CC=C(C(O)C(O)C(=O)[O-])C(O)=C1O MNX internals InChI (mnx) InChI=1/C10H9NO7/c12-3-11-5-2-1-4(6(13)8(5)15)7(14)9(16)10(17)18/h1-2,7,9,13-16H,(H,17,18)/t7?,9? SMILES (mnx) [CH:1]1=[CH:2][C:5]([N:11]=[C:3]=[O:12])=[C:8]([OH:15])[C:6]([OH:13])=[C:4]1[CH:7]([CH:9]([C:10](=[O:17])[OH:18])[OH:16])[OH:14]

Parent-child relations graph

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