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Substance Name: Tetrondrine dihydrochloride
RN: 1263-79-2
UNII: DDW9ZLW86P
InChIKey: WVTKBKWTSCPRNU-LOYHVIPDSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C38-H42-N2-O6

Molecular Weight

  • 622.758
 
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Names and Synonyms

Name of Substance

  • Tetrondrine dihydrochloride

Synonyms

  • (-)-Tetrandrine
  • Berbaman, 6,6',7,12-tetramethoxy-2,2'-dimethyl-, (1'-beta)-
  • NSC 105130
  • O,O-Dimethylkrukovine
  • PHAEANTHINE
  • Pheanthine
  • Tetrondrine HCl
  • UNII-DDW9ZLW86P

Systematic Names

  • 16H-1,24:6,9-Dietheno-11,15-metheno-2H-pyrido(2',3':17,18)(1,11)dioxacycloeicosino(2,3,4-ij)isoquinoline, 3,4,4a,5,16a,17,18,190octahydro-12,21,22,26-tetramethoxy-4,17-dimethyl-, (4aR,16aR)-
  • Pheanthine

Registry Numbers

CAS Registry Number

  • 1263-79-2

FDA UNII

  • DDW9ZLW86P

System Generated Number

  • 0001263792

Structure Descriptors

InChI

1S/C38H42N2O6/c1-39-15-13-25-20-32(42-4)34-22-28(25)29(39)17-23-7-10-27(11-8-23)45-33-19-24(9-12-31(33)41-3)18-30-36-26(14-16-40(30)2)21-35(43-5)37(44-6)38(36)46-34/h7-12,19-22,29-30H,13-18H2,1-6H3/t29-,30-/m1/s1

InChIKey

WVTKBKWTSCPRNU-LOYHVIPDSA-N

Smiles

c12c3[C@H]([N@@](C)CCc3cc(c2OC)OC)Cc2cc(Oc3ccc(C[C@@H]4c5cc(O1)c(cc5CC[N@@]4C)OC)cc3)c(cc2)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 60mg/kg (60mg/kg)   Annales Pharmaceutiques Francaises. Vol. 21, Pg. 829, 1963.