compound 0215075

Properties Image MNX_ID MNXM1175339 reference envipathM:...1e4899dbd5f9 formula C10H12Cl2O5 global charge 0 mol weight 283.107 InChIKey PWQJDTYMALGIEH-UHFFFAOYSA-N InChI InChI=1S/C10H12Cl2O5/c11-4-1-2-5(14)8(12)7(4)10(17)9(16)6(15)3-13/h1-2,6,9-10,13-17H,3H2 SMILES OCC(O)C(O)C(O)C1=C(Cl)C(O)=CC=C1Cl MNX internals InChI (mnx) InChI=1/C10H12Cl2O5/c11-4-1-2-5(14)8(12)7(4)10(17)9(16)6(15)3-13/h1-2,6,9-10,13-17H,3H2/t6?,9?,10? SMILES (mnx) [CH:1]1=[CH:2][C:5]([OH:14])=[C:8]([Cl:12])[C:7]([CH:10]([CH:9]([CH:6]([CH2:3][OH:13])[OH:15])[OH:16])[OH:17])=[C:4]1[Cl:11]

Parent-child relations graph

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