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Substance Name: Insularinium, 2,2'-dimethyl-, diiodide
RN: 32434-10-9
InChIKey: VLEJUPZBRNCDCU-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C40-H46-N2-O6.2I

Molecular Weight

  • 904.611
 
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Names and Synonyms

Synonyms

  • 2,2'-Dimethylinsularinium diiodide
  • Insularine dimethiodide

Systematic Name

  • Insularinium, 2,2'-dimethyl-, diiodide

Registry Numbers

CAS Registry Number

  • 32434-10-9

System Generated Number

  • 0032434109

Molecular Formulas

Molecular Formula

  • C40-H46-N2-O6.2I

Molecular Formula Fragments

  • C40-H46-N2-O6
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C40H46N2O6.2HI/c1-41(2)16-15-27-22-34(44-6)38-40-36(27)30(41)19-24-8-11-29(12-9-24)47-39-35-26(21-33(43-5)37(39)45-7)14-17-42(3,4)31(35)20-25-10-13-32(48-40)28(18-25)23-46-38;;/h8-13,18,21-22,30-31H,14-17,19-20,23H2,1-7H3;2*1H/q+2;;/p-2

InChIKey

VLEJUPZBRNCDCU-UHFFFAOYSA-L

Smiles

c12c3c4c(OC)cc1CC[N+]([C@@H]2Cc1ccc(Oc2c(c(OC)cc5c2[C@@H](Cc2cc(c(O3)cc2)CO4)[N+](CC5)(C)C)OC)cc1)(C)C.[IH-].[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 10mg/kg (10mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 24, Pg. 2413, 1976.