compound 0054780

Properties Image MNX_ID MNXM1182040 reference envipathM:...8b554e0228c8 formula C14H9Cl5O4 global charge 0 mol weight 418.487 InChIKey FFFXZIVDOWXFJI-UHFFFAOYSA-N InChI InChI=1S/C14H9Cl5O4/c15-7-3-1-6(2-4-7)13(23,14(17,18)19)8-5-9(20)10(16)12(22)11(8)21/h1-5,20-23H SMILES OC1=CC(C(O)(C2=CC=C(Cl)C=C2)C(Cl)(Cl)Cl)=C(O)C(O)=C1Cl MNX internals InChI (mnx) InChI=1/C14H9Cl5O4/c15-7-3-1-6(2-4-7)13(23,14(17,18)19)8-5-9(20)10(16)12(22)11(8)21/h1-5,20-23H/t13? SMILES (mnx) [CH:1]1=[CH:3][C:7]([Cl:15])=[CH:4][CH:2]=[C:6]1[C:13]([C:8]1=[CH:5][C:9]([OH:20])=[C:10]([Cl:16])[C:12]([OH:22])=[C:11]1[OH:21])([C:14]([Cl:17])([Cl:18])[Cl:19])[OH:23]

Parent-child relations graph

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