compound 0225641

Properties Image MNX_ID MNXM1176057 reference envipathM:...bc810e3e330f formula C15H12NO6 global charge -1 mol weight 302.262 InChIKey DXTVPULWZQOUNG-WDZFZDKYSA-M InChI InChI=1S/C15H13NO6/c1-7(17)16-9-2-3-10-8(4-9)5-12(18)11(10)6-13(19)14(20)15(21)22/h2-4,6,14,20H,5H2,1H3,(H,16,17)(H,21,22)/p-1/b11-6- SMILES CC(=O)NC1=CC=C2C(=C1)CC(=O)/C2=C\C(=O)C(O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C15H13NO6/c1-7(17)16-9-2-3-10-8(4-9)5-12(18)11(10)6-13(19)14(20)15(21)22/h2-4,6,14,20H,5H2,1H3,(H,16,17)(H,21,22)/b11-6-/t14? SMILES (mnx) [CH3:1][C:7](=[N:16][C:9]1=[CH:4][C:8]2=[C:10]([CH:3]=[CH:2]1)/[C:11](=[CH:6]/[C:13]([CH:14]([C:15](=[O:21])[OH:22])[OH:20])=[O:19])[C:12](=[O:18])[CH2:5]2)[OH:17]

Parent-child relations graph

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