Type: | Other |
PubChem: | 72236 |
DrugBank: | None |
IUPAC: | 5-benzamido-3-[5-[[4-chloro-6-(4-sulfoanilino)-1,3,5-triazin-2-yl]amino]-2-sulfophenyl]azo-4-hydroxynaphthalene-2,7-disulfonic acid |
Standard InChI: | InChI=1S/C32H23ClN8O14S4/c33-30-37-31(34-18-6-9-20(10-7-18)56(44,45)46)39-32(38-30)35-19-8-11-24(58(50,51)52)22(14-19)40-41-27-25(59(53,54)55)13-17-12-21(57(47,48)49)15-23(26(17)28(27)42)36-29(43)16-4-2-1-3-5-16/h1-15,42H,(H,36,43)(H,44,45,46)(H,47,48,49)(H,50,51,52)(H,53,54,55)(H2,34,35,37,38,39) |
Standard InChIKey: | ZWONWYNZSWOYQC-UHFFFAOYSA-N |
SMILES: | O=C(NC1=CC(S(=O)(=O)O)=CC2=CC(S(=O)(=O)O)=C(N=NC3=CC(NC4=NC(Cl)=NC(NC5=CC=C(S(=O)(=O)O)C=C5)=N4)=CC=C3S(=O)(=O)O)C(O)=C12)C1=CC=CC=C1 |
Metabolism-related information: | No data |
Reference: | No data |
Chemical Structure | Metablite's name | Reaction name | Genus | Species | Reference |
---|---|---|---|---|---|
None | Unknown | Reduction | Clostridium | Unknown | 10.1016/bs.pmbts.2020.04.002 |