4DS
4,4'-Diisothiocyano-2,2'-stilbenedisulfonic acid
Find entries where: 4DS
is present as a standalone ligand in 1 entries
as a non-polymer is covalently linked to polymer or other heterogen groups 2 entries
Chemical Component Summary | |
|---|---|
| Name | 4,4'-Diisothiocyano-2,2'-stilbenedisulfonic acid |
| Identifiers | 5-isothiocyanato-2-[(E)-2-(4-isothiocyanato-2-sulfo-phenyl)ethenyl]benzenesulfonic acid |
| Formula | C16 H10 N2 O6 S4 |
| Molecular Weight | 454.52 |
| Type | NON-POLYMER |
| Isomeric SMILES | c1cc(c(cc1N=C=S)S(=O)(=O)O)/C=C/c2ccc(cc2S(=O)(=O)O)N=C=S |
| InChI | InChI=1S/C16H10N2O6S4/c19-27(20,21)15-7-13(17-9-25)5-3-11(15)1-2-12-4-6-14(18-10-26)8-16(12)28(22,23)24/h1-8H,(H,19,20,21)(H,22,23,24)/b2-1+ |
| InChIKey | YSCNMFDFYJUPEF-OWOJBTEDSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 38 |
| Chiral Atom Count | 0 |
| Bond Count | 39 |
| Aromatic Bond Count | 12 |
Related Resource References
| Resource Name | Reference |
|---|---|
| Pharos | CHEMBL1162148 |
| PubChem | 5281951 |
| ChEMBL | CHEMBL1162148 |
| ChEBI | CHEBI:36511, CHEBI:4286 |
