DTXSID8062238
tetrasodium;4-hydroxy-7-[[4-[[5-hydroxy-6-[(4-methoxy-2-sulfonatophenyl)diazenyl]-7-sulfonatonaphthalen-2-yl]amino]-6-morpholin-4-yl-1,3,5-triazin-2-yl]amino]-3-[(4-methoxy-2-sulfonatophenyl)diazenyl]naphthalene-2-sulfonate
| Molecular Formula | C41H32N10Na4O17S4 |
|---|---|
| Molecular Weight | 1157.0 g/mol |
| Topological Polar Surface Area | 446.0 A2 |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 27 |
| Rotatable Bonds | 11 |
| Exact Mass | 1156.042 |
| Heavy Atoms | 76 |
| Complexity | 2150.0 |
Chemical Identifiers
| CAS Number | 2184-11-4 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(=NC(=N4)N5CCOCC5)NC6=CC7=CC(=C(C(=C7C=C6)O)N=NC8=C(C=C(C=C8)OC)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+] |
| InChIKey | ZPEKYFQIEQELMD-UHFFFAOYSA-J |
📖 Product Overview
DTXSID8062238 (CAS: 2184-11-4) is a chemical compound with molecular formula C41H32N10Na4O17S4 and molecular weight 1157.0 g/mol. Its IUPAC systematic name is tetrasodium;4-hydroxy-7-[[4-[[5-hydroxy-6-[(4-methoxy-2-sulfonatophenyl)diazenyl]-7-sulfonatonaphthalen-2-yl]amino]-6-morpholin-4-yl-1,3,5-triazin-2-yl]amino]-3-[(4-methoxy-2-sulfonatophenyl)diazenyl]naphthalene-2-sulfonate.
ZPEKYFQIEQELMD-UHFFFAOYSA-J.
SMILES: COC1=CC(=C(C=C1)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(=NC(=N4)N5CCOCC5)NC6=CC7=CC(=C(C(=C7C=C6)O)N=NC8=C(C=C(C=C8)OC)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].
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