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Substance Name: HE 3562
RN: 13611-97-7
InChIKey: PVHMKHVQVIUQIP-PWGKOOIMSA-N

Classification Codes

  • Hormone
  • Mutation Data

Molecular Formula

  • C21-H30-O2

Molecular Weight

  • 314.466
 
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Names and Synonyms

Results Name

  • HE 3562

Synonyms

  • 17-Hydroxy-5-alpha,17-alpha-pregn-20-yn-3-one
  • 5-alpha-Androstan-17-alpha-ethynyl-17-beta-ol-3-one
  • Pregn-20-yn-3-one, 17-hydroxy-, (5-alpha,17-alpha)-

Systematic Name

  • 5-alpha,17-alpha-Pregn-20-yn-3-one, 17-hydroxy-

Registry Numbers

CAS Registry Number

  • 13611-97-7

System Generated Number

  • 0013611977

Structure Descriptors

InChI

1S/C21H30O2/c1-4-21(23)12-9-18-16-6-5-14-13-15(22)7-10-19(14,2)17(16)8-11-20(18,21)3/h1,14,16-18,23H,5-13H2,2-3H3/t14-,16+,17-,18-,19-,20-,21?/m0/s1

InChIKey

PVHMKHVQVIUQIP-PWGKOOIMSA-N

Smiles

C1(CC[C@@]2([C@H]3CC[C@@]4([C@@](CC[C@@H]4[C@@H]3CC[C@@H]2C1)(C#C)O)C)C)=O