Chemical Compound

127617-74-7

CAS Registry Number 127617-74-7
127617-74-7 chemical structure
Primary Record

127617-74-7

In stock
8,785 g
Purity
98.1 %
CAS
127617-74-7

Compound Identifiers & Properties

CAS
127617-74-7
PubChem CID
16131092
SMILES
CC1=C2C=C[N+](=CC2=C(C3=C1NC4=C3C=C(C=C4)OC)C)CCCCC(=O)NC5=CC=C(C=C5)C6=C7C=CC(=C(C8=NC(=C(C9=CC=C([N-]9)C(=C1C=CC6=N1)C1=CC=[N+](C=C1)C)C1=CC=[N+](C=C1)C)C=C8)C1=CC=[N+](C=C1)C)[N-]7.CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Mn+3]
Canonical SMILES
CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].COc1ccc2[nH]c3c(C)c4cc[n+](CCCCC(=O)Nc5ccc(-c6c7nc(c(-c8cc[n+](C)cc8)c8ccc([n-]8)c(-c8cc[n+](C)cc8)c8nc(c(-c9cc[n+](C)cc9)c9ccc6[n-]9)C=C8)C=C7)cc5)cc4c(C)c3c2c1.[Mn+3]

Names & Synonyms

  • 127617-74-7
  • 2-(5-Oxo-5-(tris(methylpyridinium)acetato-manganese-porphinyl)phenylaminopentyl)ellipticine tetraacetate
  • manganese(3+);5-(9-methoxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)-N-[4-[10,15,20-tris(1-methylpyridin-1-ium-4-yl)porphyrin-22,24-diid-5-yl]phenyl]pentanamide;pentaacetate