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Substance Name: Toxiferine I, 18-deoxy-2,2'-epoxy-
RN: 69356-55-4
InChIKey: DWELRYDMYVJVSL-NOSIZSRCSA-N

Molecular Formula

  • C40-H44-N4-O2

Molecular Weight

  • 596.8146
 
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Names and Synonyms

Synonyms

  • 18-Deoxy-2,2'-epoxytoxiferine I
  • C-Alkaloid G

Systematic Name

  • Toxiferine I, 18-deoxy-2,2'-epoxy-

Registry Numbers

CAS Registry Number

  • 69356-55-4

System Generated Number

  • 0069356554

Structure Descriptors

InChI

1S/C40H44N4O/c1-5-25-23-43(3)17-15-37-29-11-7-10-14-34(29)42-22-32-28-20-36-38(16-18-44(36,4)24-26(28)6-2)30-12-8-9-13-33(30)41-21-31(27(25)19-35(37)43)39(37,42)45-40(32,38)41/h5-14,21-22,27-28,35-36H,15-20,23-24H2,1-4H3/q+2/b25-5-,26-6+

InChIKey

DWELRYDMYVJVSL-NOSIZSRCSA-N

Smiles

C/C=C/1\C[N+]2(CCC34C2CC1C5=CN6c7ccccc7C89C61C(=CN(C53O1)c1c4cccc1)C\1CC8[N+](CC9)(C/C1=C/C)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intravenous 700ng/kg (0.0007mg/kg) PERIPHERAL NERVE AND SENSATION: SPASTIC PARALYSIS WITH OR WITHOUT SENSORY CHANGE Helvetica Physiologica et Pharmacologica Acta, Supplementum. Vol. 8, Pg. 1, 1953.