Moxestrol

CAS Registry Number®

34816-55-2

CAS Name

Moxestrol

Molecular Formula

C21H26O3

Molecular Mass

326.43

Cite this Page

Moxestrol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=34816-55-2 (retrieved 2024-11-22) (CAS RN: 34816-55-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    280 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C21H26O3/c1-4-21(23)10-9-17-16-7-5-13-11-14(22)6-8-15(13)19(16)18(24-3)12-20(17,21)2/h1,6,8,11,16-19,22-23H,5,7,9-10,12H2,2-3H3/t16-,17-,18-,19+,20-,21-/m0/s1

InChIKey

InChIKey=MTMZZIPTQITGCY-OLGWUGKESA-N

SMILES

O(C)[C@@H]1[C@]2([C@]([C@]3([C@](C)(C1)[C@@](C#C)(O)CC3)[H])(CCC=4C2=CC=C(O)C4)[H])[H]

Canonical SMILES

C#CC1(O)CCC2C3CCC4=CC(O)=CC=C4C3C(OC)CC21C

Other Names for this Substance

  • 19-Norpregna-1,3,5(10)-trien-20-yne-3,17-diol, 11-methoxy-, (11β,17α)-
  • 19-Nor-17α-pregna-1,3,5(10)-trien-20-yne-3,17-diol, 11β-methoxy-
  • (11β,17α)-11-Methoxy-19-norpregna-1,3,5(10)-trien-20-yne-3,17-diol
  • R 2858
  • 11β-Methoxy-17-ethynyl-1,3,5(10)-estratriene-3,17β-diol

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Deleted or Replaced CAS Registry Numbers

21375-12-2