compound 0074001

Properties Image MNX_ID MNXM1138989 reference envipathM:...d1b0c14aea3c formula C14H11NO6 global charge 0 mol weight 289.243 InChIKey LEGROWTYANKFIT-UHFFFAOYSA-N InChI InChI=1S/C14H11NO6/c16-7-15-9-3-1-8(2-4-9)5-10-11(17)6-12(18)14(20)21-13(10)19/h1-4,10,18,20H,5-6H2 SMILES O=C=NC1=CC=C(CC2C(=O)CC(O)=C(O)OC2=O)C=C1 MNX internals InChI (mnx) InChI=1/C14H11NO6/c16-7-15-9-3-1-8(2-4-9)5-10-11(17)6-12(18)14(20)21-13(10)19/h1-4,10,18,20H,5-6H2/t10? SMILES (mnx) [CH:1]1=[CH:3][C:9]([N:15]=[C:7]=[O:16])=[CH:4][CH:2]=[C:8]1[CH2:5][CH:10]1[C:11](=[O:17])[CH2:6][C:12]([OH:18])=[C:14]([OH:20])[O:21][C:13]1=[O:19]

Parent-child relations graph

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