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Substance Name: A-Norpregn-20-yne-2,17-diol, 2-ethynyl-, 2-(1-piperidineacetate), (2-beta,5-alpha,17-alpha)-
RN: 142546-47-2
InChIKey: KEXJXJANNODKLR-WTXVQDOXSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Reproductive Effect

Molecular Formula

  • C29-H41-N-O3

Molecular Weight

  • 451.6469
 
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Names and Synonyms

Synonym

  • (2-beta,5-alpha,17-alpha)-2-Ethynyl-A-norpregn-20-yne-2,17-diol 2-(1-piperidineacetate)

Systematic Name

  • A-Norpregn-20-yne-2,17-diol, 2-ethynyl-, 2-(1-piperidineacetate), (2-beta,5-alpha,17-alpha)-

Registry Numbers

CAS Registry Number

  • 142546-47-2

System Generated Number

  • 0142546472

Structure Descriptors

InChI

1S/C29H41NO3/c1-5-28(33-25(31)19-30-16-8-7-9-17-30)18-21-10-11-22-23(26(21,3)20-28)12-14-27(4)24(22)13-15-29(27,32)6-2/h1-2,21-24,32H,7-20H2,3-4H3/t21?,22?,23-,24?,26-,27?,28+,29?/m0/s1

InChIKey

KEXJXJANNODKLR-WTXVQDOXSA-N

Smiles

C[C@]12C[C@](CC1CCC3[C@@H]2CCC4(C3CCC4(C#C)O)C)(C#C)OC(=O)CN5CCCCC5