Gestrinone

CAS Registry Number®

16320-04-0

CAS Name

Gestrinone

Molecular Formula

C21H24O2

Molecular Mass

308.41

Cite this Page

Gestrinone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=40542-65-2 (retrieved 2024-11-24) (CAS RN: 16320-04-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    154 °C

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C21H24O2/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,9,11,13,18-19,23H,3,5-8,10,12H2,1H3/t18-,19+,20+,21+/m1/s1

InChIKey

InChIKey=BJJXHLWLUDYTGC-ANULTFPQSA-N

SMILES

C(C)[C@@]12[C@]([C@]3(C(C=C1)=C4C(CC3)=CC(=O)CC4)[H])(CC[C@]2(C#C)O)[H]

Canonical SMILES

O=C1C=C2C(=C3C=CC4(CC)C(CCC4(O)C#C)C3CC2)CC1

Other Names for this Substance

  • 18,19-Dinorpregna-4,9,11-trien-20-yn-3-one, 13-ethyl-17-hydroxy-, (17α)-
  • 18,19-Dinor-17α-pregna-4,9,11-trien-20-yn-3-one, 13-ethyl-17-hydroxy-
  • (17α)-13-Ethyl-17-hydroxy-18,19-dinorpregna-4,9,11-trien-20-yn-3-one
  • R 2323
  • 13-Ethyl-17α-ethynyl-17β-hydroxygona-4,9,11-trien-3-one

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Deleted or Replaced CAS Registry Numbers

40542-65-2

CAS INSIGHTSTM
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