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Substance Name: Rubijervine hydrobromide
RN: 6155-47-1
UNII: 315F1IML2G
InChIKey: PPEMMFKVVCNBIW-VSLCWLCYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H43-N-O2.Br-H

Molecular Weight

  • 494.554
 
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Names and Synonyms

Name of Substance

  • Rubijervine hydrobromide

Synonyms

  • delta(sup 5)-3-beta,12-alpha-Dihydroxysolanidene hydrobromide
  • Rubigervine hydrobromide
  • Rubijervine hydrobromide
  • UNII-315F1IML2G

Systematic Name

  • Solanid-5-ene-3-beta,12-alpha-diol, hydrobromide

Registry Numbers

CAS Registry Number

  • 6155-47-1

FDA UNII

  • 315F1IML2G

System Generated Number

  • 0006155471

Molecular Formulas

Molecular Formula

  • C27-H43-N-O2.Br-H

Molecular Formula Fragments

  • Br-H
  • C27-H43-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C27H43NO2.BrH/c1-15-5-8-22-16(2)25-23(28(22)14-15)12-21-19-7-6-17-11-18(29)9-10-26(17,3)20(19)13-24(30)27(21,25)4;/h6,15-16,18-25,29-30H,5,7-14H2,1-4H3;1H/t15-,16+,18-,19+,20-,21-,22+,23-,24-,25-,26-,27+;/m0./s1

InChIKey

PPEMMFKVVCNBIW-VSLCWLCYSA-N

Smiles

C1[C@@H](CC2=CC[C@H]3[C@@H]4C[C@@H]5[N@@]6C[C@@H](C)CC[C@@H]6[C@H](C)[C@H]5[C@@]4(C)[C@H](C[C@H]3[C@@]2(C1)C)O)O.Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 70mg/kg (70mg/kg)   "Merck Index; an Encyclopedia of Chemicals, Drugs, and Biologicals", 11th ed., Rahway, NJ 07065, Merck & Co., Inc. 1989Vol. 11, Pg. 1317, 1989.