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Substance Name: Decaprenylamine hydrochloride
RN: 77388-50-2
InChIKey: RZXYKAPSYZDSNM-CRAXORESSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C50-H83-N.Cl-H

Molecular Weight

  • 734.6736
 
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Names and Synonyms

Results Name

  • Decaprenylamine hydrochloride

Synonyms

  • Decaprenylamine HCl
  • Decaprenylamine hydrochloride

Systematic Name

  • 2,6,10,14,18,22,26,30,34,38-Tetracontadecaen-1-amine, 3,7,11,15,19,23,27,31,35,39-decamethyl-,hydrochloride

Registry Numbers

CAS Registry Number

  • 77388-50-2

System Generated Number

  • 0077388502

Molecular Formulas

Molecular Formula

  • C50-H83-N.Cl-H

Molecular Formula Fragments

  • C50-H83-N
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C50H83N.ClH/c1-41(2)21-12-22-42(3)23-13-24-43(4)25-14-26-44(5)27-15-28-45(6)29-16-30-46(7)31-17-32-47(8)33-18-34-48(9)35-19-36-49(10)37-20-38-50(11)39-40-51;/h21,23,25,27,29,31,33,35,37,39H,12-20,22,24,26,28,30,32,34,36,38,40,51H2,1-11H3;1H/b42-23+,43-25+,44-27+,45-29+,46-31+,47-33+,48-35+,49-37+,50-39+;

InChIKey

RZXYKAPSYZDSNM-CRAXORESSA-N

Smiles

CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CN)/C)/C)/C)/C)/C)/C)/C)/C)/C)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1294ug/kg (1.294mg/kg)   JNCI, Journal of the National Cancer Institute. Vol. 73, Pg. 903, 1984.
mouse LD50 intravenous 38500ug/kg (38.5mg/kg)   JNCI, Journal of the National Cancer Institute. Vol. 73, Pg. 903, 1984.