Tetrabromophenol blue

Properties Image MNX_ID MNXM161474 reference chebi:176933 formula C19H6Br8O5S global charge 0 mol weight 985.551 InChIKey QPMIVFWZGPTDPN-UHFFFAOYSA-N InChI InChI=1S/C19H6Br8O5S/c20-7-1-5(2-8(21)16(7)28)19(6-3-9(22)17(29)10(23)4-6)11-12(24)13(25)14(26)15(27)18(11)33(30,31)32-19/h1-4,28-29H SMILES O=S1(=O)OC(C2=CC(Br)=C(O)C(Br)=C2)(C2=CC(Br)=C(O)C(Br)=C2)C2=C1C(Br)=C(Br)C(Br)=C2Br MNX internals InChI (mnx) InChI=1/C19H6Br8O5S/c20-7-1-5(2-8(21)16(7)28)19(6-3-9(22)17(29)10(23)4-6)11-12(24)13(25)14(26)15(27)18(11)33(30,31)32-19/h1-4,28-29H SMILES (mnx) [CH:1]1=[C:5]([C:19]2([C:6]3=[CH:3][C:9]([Br:22])=[C:17]([OH:29])[C:10]([Br:23])=[CH:4]3)[C:11]3=[C:12]([Br:24])[C:13]([Br:25])=[C:14]([Br:26])[C:15]([Br:27])=[C:18]3[S:33](=[O:30])(=[O:31])[O:32]2)[CH:2]=[C:8]([Br:21])[C:16]([OH:28])=[C:7]1[Br:20]

Parent-child relations graph

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