4-Methoxyestrone

CAS Registry Number®

58562-33-7

CAS Name

4-Methoxyestrone

Molecular Formula

C19H24O3

Molecular Mass

300.39

Cite this Page

4-Methoxyestrone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=58562-33-7 (retrieved 2024-11-24) (CAS RN: 58562-33-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C19H24O3/c1-19-10-9-12-11-5-7-16(20)18(22-2)14(11)4-3-13(12)15(19)6-8-17(19)21/h5,7,12-13,15,20H,3-4,6,8-10H2,1-2H3/t12-,13-,15+,19+/m1/s1

InChIKey

InChIKey=PUEXVLNGOBYUEW-BFDPJXHCSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@](C=4C(CC3)=C(OC)C(O)=CC4)(CC1)[H])[H])(CCC2=O)[H]

Canonical SMILES

O=C1CCC2C3CCC4=C(OC)C(O)=CC=C4C3CCC12C

Other Names for this Substance

  • Estra-1,3,5(10)-trien-17-one, 3-hydroxy-4-methoxy-
  • Estrone, 4-methoxy-
  • 3-Hydroxy-4-methoxyestra-1,3,5(10)-trien-17-one
  • 4-Methoxyestrone

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