compound 0058791

Properties Image MNX_ID MNXM1138244 reference envipathM:...f929d147b6f3 formula C12H6Br4O3 global charge 0 mol weight 517.793 InChIKey QECZEOAPDHVWDR-UHFFFAOYSA-N InChI InChI=1S/C12H6Br4O3/c13-5-1-2-8(6(14)3-5)19-9-4-7(15)10(16)12(18)11(9)17/h1-4,17-18H SMILES OC1=C(O)C(Br)=C(Br)C=C1OC1=CC=C(Br)C=C1Br MNX internals InChI (mnx) InChI=1/C12H6Br4O3/c13-5-1-2-8(6(14)3-5)19-9-4-7(15)10(16)12(18)11(9)17/h1-4,17-18H SMILES (mnx) [CH:1]1=[CH:2][C:8]([O:19][C:9]2=[C:11]([OH:17])[C:12]([OH:18])=[C:10]([Br:16])[C:7]([Br:15])=[CH:4]2)=[C:6]([Br:14])[CH:3]=[C:5]1[Br:13]

Parent-child relations graph

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