compound 0084883

Properties Image MNX_ID MNXM1193813 reference envipathM:...c906e2237421 formula C12H13Cl3O5 global charge 0 mol weight 343.59 InChIKey MHCSWODEZKGHAM-UHFFFAOYSA-N InChI InChI=1S/C12H13Cl3O5/c13-4-2-10(19)8(14)11(4,15)6-3-1-9(18,12(6,10)20)7(17)5(3)16/h2-3,5-8,16-20H,1H2 SMILES OC1C2CC(O)(C1O)C1(O)C2C2(Cl)C(Cl)=CC1(O)C2Cl MNX internals InChI (mnx) InChI=1/C12H13Cl3O5/c13-4-2-10(19)8(14)11(4,15)6-3-1-9(18,12(6,10)20)7(17)5(3)16/h2-3,5-8,16-20H,1H2/t3?,5?,6?,7?,8?,9?,10?,11?,12? SMILES (mnx) [CH2:1]1[CH:3]2[CH:5]([OH:16])[CH:7]([OH:17])[C:9]1([OH:18])[C:12]1([OH:20])[CH:6]2[C:11]2([Cl:15])[C:4]([Cl:13])=[CH:2][C:10]1([OH:19])[CH:8]2[Cl:14]

Parent-child relations graph

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