compound 0073664

Properties Image MNX_ID MNXM1196824 reference envipathM:...5ff06fd25c9f formula C14H14NO7 global charge -1 mol weight 308.266 InChIKey SJARHCSFBDQEKW-UHFFFAOYSA-M InChI InChI=1S/C14H15NO7/c16-7-15-9-3-1-8(2-4-9)5-10(17)13(21)14(22)11(18)6-12(19)20/h1-4,11,14,17-18,21-22H,5-6H2,(H,19,20)/p-1 SMILES O=C=NC1=CC=C(CC(O)=C(O)C(O)C(O)CC(=O)[O-])C=C1 MNX internals InChI (mnx) InChI=1/C14H15NO7/c16-7-15-9-3-1-8(2-4-9)5-10(17)13(21)14(22)11(18)6-12(19)20/h1-4,11,14,17-18,21-22H,5-6H2,(H,19,20)/b13-10?/t11?,14? SMILES (mnx) [CH:1]1=[CH:3][C:9]([N:15]=[C:7]=[O:16])=[CH:4][CH:2]=[C:8]1[CH2:5][C:10](=[C:13]([CH:14]([CH:11]([CH2:6][C:12](=[O:19])[OH:20])[OH:18])[OH:22])[OH:21])[OH:17]

Parent-child relations graph

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