compound 0055909

Properties Image MNX_ID MNXM1177189 reference envipathM:...13220e508112 formula C12H9O5 global charge -1 mol weight 233.199 InChIKey CGHHVXMENBUGIT-UHFFFAOYSA-M InChI InChI=1S/C12H10O5/c13-9-6-4-8(5-7-9)10(14)2-1-3-11(15)12(16)17/h1-2,4-7,13H,3H2,(H,16,17)/p-1 SMILES O=C([O-])C(=O)CC=CC(=O)C1=CC=C(O)C=C1 MNX internals InChI (mnx) InChI=1/C12H10O5/c13-9-6-4-8(5-7-9)10(14)2-1-3-11(15)12(16)17/h1-2,4-7,13H,3H2,(H,16,17)/b2-1? SMILES (mnx) [CH:1](=[CH:2][C:10]([C:8]1=[CH:5][CH:7]=[C:9]([OH:13])[CH:6]=[CH:4]1)=[O:14])[CH2:3][C:11]([C:12]([OH:16])=[O:17])=[O:15]

Parent-child relations graph

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