(3β,5α,17E)-3-Ethynyl-3-hydroxyandrostan-17-one oxime

CAS Registry Number®

2089238-18-4
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CAS Name

(3β,5α,17E)-3-Ethynyl-3-hydroxyandrostan-17-one oxime

Molecular Formula

C21H31NO2

Molecular Mass

329.48

Cite this Page

(3β,5α,17E)-3-Ethynyl-3-hydroxyandrostan-17-one oxime.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=2089238-18-4 (retrieved 2024-04-16) (CAS RN: 2089238-18-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H31NO2/c1-4-21(23)12-11-19(2)14(13-21)5-6-15-16-7-8-18(22-24)20(16,3)10-9-17(15)19/h1,14-17,23-24H,5-13H2,2-3H3/b22-18+/t14-,15-,16-,17-,19-,20-,21-/m0/s1

InChIKey

InChIKey=FFIBGVYTWNPLPN-BZLGYYABSA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)\C(=N\O)\CC4)[H])(CC[C@]1(C[C@@](C#C)(O)CC2)[H])[H])[H]

Canonical SMILES

C#CC1(O)CCC2(C)C(CCC3C4CCC(=NO)C4(C)CCC32)C1

Other Names for this Substance

  • Androstan-17-one, 3-ethynyl-3-hydroxy-, oxime, (3β,5α,17E)-
  • (3β,5α,17E)-3-Ethynyl-3-hydroxyandrostan-17-one oxime
  • Golexanolone
  • GR3027

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