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Substance Name: 5-alpha-Pregnan-3-alpha-amine, acetate
RN: 25665-93-4
InChIKey: JEIDUNUFDJGJOF-FVWCGPCDSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H37-N.C2-H4-O2

Molecular Weight

  • 363.5819
 
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Names and Synonyms

Synonyms

  • 3-alpha-Aminopregnane acetate
  • Acetate de 3 alpha-amino-pregnane
  • Acetate de 3 alpha-amino-pregnane [French]

Systematic Name

  • 5-alpha-Pregnan-3-alpha-amine, acetate

Registry Numbers

CAS Registry Number

  • 25665-93-4

System Generated Number

  • 0025665934

Molecular Formulas

Molecular Formula

  • C21-H37-N.C2-H4-O2

Molecular Formula Fragments

  • C2-H4-O2
  • C21-H37-N
  • COMPONENT

Structure Descriptors

InChI

1S/C21H37N.C2H4O2/c1-4-14-6-8-18-17-7-5-15-13-16(22)9-11-21(15,3)19(17)10-12-20(14,18)2;1-2(3)4/h14-19H,4-13,22H2,1-3H3;1H3,(H,3,4)/t14-,15-,16+,17-,18-,19-,20+,21-;/m0./s1

InChIKey

JEIDUNUFDJGJOF-FVWCGPCDSA-N

Smiles

CC[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](N)CC[C@]4(C)[C@H]3CC[C@]12C.CC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 143mg/kg (143mg/kg) LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)		 Annales Pharmaceutiques Francaises. Vol. 27, Pg. 191, 1969.