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Substance Name: Carbamic acid, ((3-beta,5-alpha,17-beta)-3-hydroxyandrostan-17-yl)-, methyl ester
RN: 126054-45-3
InChIKey: CEZKLEHYJURHTB-MNZDUMJDSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H35-N-O3

Molecular Weight

  • 349.5115
 
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Names and Synonyms

Synonym

  • 3-beta-Hydroxy-17-beta-methoxycarbamoyl-5-alpha-androstane

Systematic Name

  • Carbamic acid, ((3-beta,5-alpha,17-beta)-3-hydroxyandrostan-17-yl)-, methyl ester

Registry Numbers

CAS Registry Number

  • 126054-45-3

System Generated Number

  • 0126054453

Structure Descriptors

InChI

1S/C21H35NO3/c1-20-10-8-14(23)12-13(20)4-5-15-16-6-7-18(22-19(24)25-3)21(16,2)11-9-17(15)20/h13-18,23H,4-12H2,1-3H3,(H,22,24)/t13-,14-,15-,16-,17-,18-,20-,21-/m0/s1

InChIKey

CEZKLEHYJURHTB-MNZDUMJDSA-N

Smiles

C[C@]12CC[C@@H](C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4NC(=O)OC)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Pharmaceutical Chemistry Journal Vol. 23, Pg. 950, 1989.