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Substance Name: C-Curarine I
RN: 7168-64-1
UNII: H84W1ZC95F
InChIKey: DWELRYDMYVJVSL-TUHIATKQSA-N

Molecular Formula

  • C40-H44-N4-O

Molecular Weight

  • 596.8146
 
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Names and Synonyms

Name of Substance

  • C-Curarine I

Synonyms

  • 18,18'-Dideoxy-2,2'-epoxytoxiferine I
  • C-Curarin I
  • EINECS 230-517-9
  • UNII-H84W1ZC95F

Systematic Names

  • 18,18'-Dideoxy-2,2'-epoxytoxiferine I
  • C-Curarine (8CI)
  • C-Curarine-I
  • Toxiferine I, 18,18'-dideoxy-2,2'-epoxy- (9CI)

Registry Numbers

CAS Registry Number

  • 7168-64-1

FDA UNII

  • H84W1ZC95F

System Generated Number

  • 0007168641

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-/t27-,28-,35-,36-,37+,38+,39+,40+,43-,44-/m0/s1

InChIKey

DWELRYDMYVJVSL-TUHIATKQSA-N

Smiles

C\C=C/1\C[N@+]2(C)CC[C@]34[C@@H]2C[C@@H]1C5=CN6c7ccccc7[C@]89CC[N@@+]%10(C)C\C(=C\C)\[C@H](C[C@@H]8%10)C%11=CN(c%12ccccc3%12)[C@]45O[C@@]69%11

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intravenous 50ug/kg (0.05mg/kg) PERIPHERAL NERVE AND SENSATION: SPASTIC PARALYSIS WITH OR WITHOUT SENSORY CHANGE Helvetica Physiologica et Pharmacologica Acta, Supplementum. Vol. 8, Pg. 1, 1953.