compound 0088253

Properties Image MNX_ID MNXM1186766 reference envipathM:...486589ba6556 formula C12H12Cl4O6 global charge 0 mol weight 394.034 InChIKey TVAIATULPNLUOP-UHFFFAOYSA-N InChI InChI=1S/C12H12Cl4O6/c13-4-2-8(20)11(22)7(19)1-3(5(17)6(7)18)10(11,21)9(4,14)12(8,15)16/h2-3,5-6,17-22H,1H2 SMILES OC1C(O)C2(O)CC1C1(O)C3(Cl)C(Cl)=CC(O)(C3(Cl)Cl)C21O MNX internals InChI (mnx) InChI=1/C12H12Cl4O6/c13-4-2-8(20)11(22)7(19)1-3(5(17)6(7)18)10(11,21)9(4,14)12(8,15)16/h2-3,5-6,17-22H,1H2/t3?,5?,6?,7?,8?,9?,10?,11? SMILES (mnx) [CH2:1]1[CH:3]2[CH:5]([OH:17])[CH:6]([OH:18])[C:7]1([OH:19])[C:11]1([OH:22])[C:8]3([OH:20])[CH:2]=[C:4]([Cl:13])[C:9]([Cl:14])([C:10]21[OH:21])[C:12]3([Cl:15])[Cl:16]

Parent-child relations graph

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