Chemical Compound

J1.054.638I

J1.054.638I chemical structure
Primary Record

J1.054.638I

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177398468
SMILES
C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)CCCCCC[N+]3=CC=C(C=C3)C4=C5C=CC(=N5)C(=C6C=CC(=C(C7=NC(=C(C8=CC=C4N8)C9=CC=C(C=C9)S(=O)(=O)[O-])C=C7)C1=CC=C(C=C1)S(=O)(=O)[O-])N6)C1=CC=C(C=C1)S(=O)(=O)[O-]
Canonical SMILES
C[n+]1ccc(-c2cc[n+](CCCCCC[n+]3ccc(-c4c5nc(c(-c6ccc(S(=O)(=O)[O-])cc6)c6ccc([nH]6)c(-c6ccc(S(=O)(=O)[O-])cc6)c6nc(c(-c7ccc(S(=O)(=O)[O-])cc7)c7ccc4[nH]7)C=C6)C=C5)cc3)cc2)cc1

Names & Synonyms

  • J1.054.638I
  • 1'-methyl-1-(6-{4-[7,12,17-tris(4-sulfonatophenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]pyridin-1-ium-1-yl}hexyl)-[4,4'-bipyridine]-1,1'-diium
  • 4-[1-[6-[4-[10,15,20-Tris(4-sulfonatophenyl)-21H,23H-porphyrin-5-yl]pyridinio]hexyl]pyridinium-4-yl]-1-methylpyridinium