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Substance Name: Anordiol
RN: 1045-30-3
InChIKey: HUUUMTTWAPMBMU-KGIOUCCPSA-N

Classification Codes

  • Contraceptive Agents
  • Contraceptive Agents, Female
  • Contraceptives, Postcoital
  • Reproductive Control Agents

Molecular Formula

  • C22-H30-O2

Molecular Weight

  • 326.477
 
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Names and Synonyms

Name of Substance

  • Anordiol

Synonyms

  • 2,17-Diethynyl-2,17-dihydroxy-A-norandrostane
  • A-Norandrostane-2alpha,17alpha-diethynyl-2beta,17beta-diol

Systematic Names

  • (2alpha,5alpha,17alpha)-2-Ethynyl-A-norpregn-20-yne-2,17-diol
  • A-Norpregn-20-yne-2,17-diol, 2-ethynyl-, (2alpha,5alpha,17alpha)-
  • Dicyclopenta(a,f)naphthalene-1,7-diol, 1,7-diethynylhexadecahydro-8a,10a-dimethyl-, (1R,3aS,3bR,5aS,7S,8aS,8bS,10aS)-

Registry Numbers

CAS Registry Number

  • 1045-30-3

System Generated Number

  • 0001045303

Structure Descriptors

InChI

1S/C22H30O2/c1-5-21(23)13-15-7-8-16-17(19(15,3)14-21)9-11-20(4)18(16)10-12-22(20,24)6-2/h1-2,15-18,23-24H,7-14H2,3-4H3/t15-,16+,17-,18-,19-,20-,21-,22-/m0/s1

InChIKey

HUUUMTTWAPMBMU-KGIOUCCPSA-N

Smiles

C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CC[C@@H]4[C@@]3(C[C@@](C4)(C#C)O)C