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Substance Name: Germine hydrochloride
RN: 5750-58-3
InChIKey: JLXCGRYYCQIBKO-WROWUMRPSA-N

Molecular Formula

  • C27-H43-N-O8.Cl-H

Molecular Weight

  • 546.0966
 
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Names and Synonyms

Results Name

  • Germine hydrochloride

Synonyms

  • Cevane-3,4,7,14,15,16,20-heptol, 4,9-epoxyhydrochloride, (3beta,4alpha,7alpha,15alpha,16beta)-
  • Germine hydrochloride

Systematic Name

  • Cevane-3-beta,4-beta,7-alpha,14,15-alpha,16-beta,20-heptol, 4,9-epoxy-, hydrochloride

Registry Numbers

CAS Registry Number

  • 5750-58-3

Related Registry Number

  • 508-65-6 (Parent)

System Generated Number

  • 0005750583

Molecular Formulas

Molecular Formula

  • C27-H43-N-O8.Cl-H

Molecular Formula Fragments

  • C27-H43-N-O8
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C27H43NO8.ClH/c1-12-4-5-17-24(3,33)19-13(11-28(17)10-12)14-9-25-21(26(14,34)22(32)20(19)31)15(29)8-16-23(25,2)7-6-18(30)27(16,35)36-25;/h12-22,29-35H,4-11H2,1-3H3;1H/t12-,13?,14-,15+,16-,17?,18-,19?,20+,21+,22-,23-,24+,25+,26-,27-;/m0./s1

InChIKey

JLXCGRYYCQIBKO-WROWUMRPSA-N

Smiles

O1[C@]23[C@@H]([C@@]4([C@H]([C@H](O)[C@@H]5[C@@H]([C@@H]4C3)C[N@@H+]3C[C@@H](C)CC[C@@H]3[C@@]5(C)O)O)O)[C@@H](C[C@@H]3[C@@]2(CC[C@@H]([C@@]13O)O)C)O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 139mg/kg (139mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

BEHAVIORAL: EXCITEMENT
Journal of Pharmacology and Experimental Therapeutics. Vol. 82, Pg. 167, 1944.