compound 0082990

Properties Image MNX_ID MNXM1184827 reference envipathM:...2d08f4801889 formula C12H14Cl4O4 global charge 0 mol weight 364.052 InChIKey ZBNNZHAORNWZNZ-UHFFFAOYSA-N InChI InChI=1S/C12H14Cl4O4/c13-4-3-7(14)11(16,8(4)15)6-2-1-10(19,12(3,6)20)9(18)5(2)17/h2-9,17-20H,1H2 SMILES OC1C2CC(O)(C1O)C1(O)C3C(Cl)C(Cl)C(Cl)(C3Cl)C21 MNX internals InChI (mnx) InChI=1/C12H14Cl4O4/c13-4-3-7(14)11(16,8(4)15)6-2-1-10(19,12(3,6)20)9(18)5(2)17/h2-9,17-20H,1H2/t2?,3?,4?,5?,6?,7?,8?,9?,10?,11?,12? SMILES (mnx) [CH2:1]1[CH:2]2[CH:5]([OH:17])[CH:9]([OH:18])[C:10]1([OH:19])[C:12]1([OH:20])[CH:3]3[CH:4]([Cl:13])[CH:8]([Cl:15])[C:11]([Cl:16])([CH:6]21)[CH:7]3[Cl:14]

Parent-child relations graph

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