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Substance Name: Quinolinium, 4-((3-amino-4-(((3-amino-4-((1-propylpyridinium-4-yl)amino)phenyl)amino)carbonyl)phenyl)amino)-1-propyl-, diiodide
RN: 53222-36-9
InChIKey: CXLONFATVARHCI-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Mutation Data

Molecular Formula

  • C33-H37-N7-O.2I

Molecular Weight

  • 801.5033
 
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Names and Synonyms

  • Quinolinium, 4-((3-amino-4-(((3-amino-4-((1-propylpyridinium-4-yl)amino)phenyl)amino)carbonyl)phenyl)amino)-1-propyl-, diiodide

Registry Numbers

CAS Registry Number

  • 53222-36-9

System Generated Number

  • 0053222369

Molecular Formulas

Molecular Formula

  • C33-H37-N7-O.2I

Molecular Formula Fragments

  • C33-H37-N7-O
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C33H35N7O.2HI/c1-3-16-39-18-13-23(14-19-39)36-31-12-10-25(22-29(31)35)38-33(41)26-11-9-24(21-28(26)34)37-30-15-20-40(17-4-2)32-8-6-5-7-27(30)32;;/h5-15,18-22H,3-4,16-17,35H2,1-2H3,(H3,34,38,41);2*1H

InChIKey

CXLONFATVARHCI-UHFFFAOYSA-N

Smiles

CCC[n+]1ccc(cc1)Nc2ccc(cc2N)NC(=O)c3ccc(cc3N)Nc4cc[n+](c5c4cccc5)CCC.[I-].[I-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intraperitoneal 15mg/kg (15mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 134, 1979.