compound 0073048

Properties Image MNX_ID MNXM1171706 reference envipathM:...9a5971e306b3 formula C12H10NO6 global charge -1 mol weight 264.213 InChIKey CGVVITBUTXZQBI-UHFFFAOYSA-M InChI InChI=1S/C12H11NO6/c14-6-13-8-5-9(15)7(11(18)12(8)19)3-1-2-4-10(16)17/h1-2,5,15,18-19H,3-4H2,(H,16,17)/p-1 SMILES O=C=NC1=C(O)C(O)=C(CC=CCC(=O)[O-])C(O)=C1 MNX internals InChI (mnx) InChI=1/C12H11NO6/c14-6-13-8-5-9(15)7(11(18)12(8)19)3-1-2-4-10(16)17/h1-2,5,15,18-19H,3-4H2,(H,16,17)/b2-1? SMILES (mnx) [CH:1](=[CH:2][CH2:4][C:10](=[O:16])[OH:17])[CH2:3][C:7]1=[C:9]([OH:15])[CH:5]=[C:8]([N:13]=[C:6]=[O:14])[C:12]([OH:19])=[C:11]1[OH:18]

Parent-child relations graph

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