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Substance Name: Samandaridin
RN: 6384-73-2
InChIKey: GUSZSGSYIVZEDM-ACYPXLHBSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H31-N-O3

Molecular Weight

  • 345.48
 
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Names and Synonyms

Results Name

  • Samandaridin

Synonyms

  • 4-27-00-06565 (Beilstein Handbook Reference)
  • BRN 0038144
  • Samandaridin
  • Samandaridine

Systematic Name

  • 3-Aza-A-homopregnan-21-oic acid, 1,4-epoxy-16-hydroxy-, gamma-lactone, (1-alpha,4-alpha-5-beta,16-beta)-

Registry Numbers

CAS Registry Number

  • 6384-73-2

System Generated Number

  • 0006384732

Structure Descriptors

InChI

1S/C21H31NO3/c1-20-6-5-13-12(14(20)8-16-15(20)9-19(23)24-16)4-3-11-7-18-22-10-17(25-18)21(11,13)2/h11-18,22H,3-10H2,1-2H3/t11-,12-,13+,14+,15+,16+,17-,18-,20+,21+/m1/s1

InChIKey

GUSZSGSYIVZEDM-ACYPXLHBSA-N

Smiles

C1(O[C@@H]2[C@H]([C@@]3([C@@H]([C@H]4[C@H](CC3)[C@@]3([C@@H](C[C@@H]5NC[C@@H]3O5)CC4)C)C2)C)C1)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 1200ug/kg (1.2mg/kg)   Pharmazie in Unserer Zeit. Vol. 15, Pg. 97, 1986.