Chemical Compound

DTXSID001340108

CAS Registry Number 70851-44-4
DTXSID001340108 chemical structure
Primary Record

DTXSID001340108

In stock
1,624 g
Purity
98.4 %
CAS
70851-44-4

Compound Identifiers & Properties

CAS
70851-44-4
PubChem CID
165360670
SMILES
CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC3=[N+](C4=C(C=CC(=C4)NC5=C(C=C(C=C5)NC6=NC(=NC(=N6)NC7=CC(=CC=C7)P(=O)(O)O)Cl)S(=O)(=O)[O-])N=C3C=C2)C8=CC(=C(C=C8)OC)S(=O)(=O)[O-].[NH4+].[NH4+].[NH4+]
Canonical SMILES
CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc2nc3ccc(Nc4ccc(Nc5nc(Cl)nc(Nc6cccc(P(=O)(O)O)c6)n5)cc4S(=O)(=O)[O-])cc3[n+](-c3ccc(OC)c(S(=O)(=O)[O-])c3)c2c1.[NH4+].[NH4+].[NH4+]

Names & Synonyms

  • DTXSID001340108
  • 70851-44-4
  • Phenazinium, 3-[[4-[[4-chloro-6-[(3-phosphonophenyl)amino]-1,3,5-triazin-2-yl]amino]-2-sulfophenyl]amino]-7-[ethyl[(3-sulfophenyl)methyl]amino]-5-(4-methoxy-3-sulfophenyl)-, inner salt, ammonium salt (1:3)