Estra-1,3,5(10)-trien-3-ol, 17-[1-(acetyloxy)-2,2,2-trichloroethoxy]-, acetate, (17β)-

CAS Registry Number®

15686-44-9

CAS Name

Estra-1,3,5(10)-trien-3-ol, 17-[1-(acetyloxy)-2,2,2-trichloroethoxy]-, acetate, (17β)-

Molecular Formula

C24H29Cl3O5

Molecular Mass

503.84

Cite this Page

Estra-1,3,5(10)-trien-3-ol, 17-[1-(acetyloxy)-2,2,2-trichloroethoxy]-, acetate, (17β)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=15686-44-9 (retrieved 2024-11-22) (CAS RN: 15686-44-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C24H29Cl3O5/c1-13(28)30-16-5-7-17-15(12-16)4-6-19-18(17)10-11-23(3)20(19)8-9-21(23)32-22(24(25,26)27)31-14(2)29/h5,7,12,18-22H,4,6,8-11H2,1-3H3/t18-,19-,20+,21+,22?,23+/m1/s1

InChIKey

InChIKey=UEVLJPRROXDIPO-CUFSGNDSSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@](C=4C(CC3)=CC(OC(C)=O)=CC4)(CC1)[H])[H])(CC[C@@H]2OC(OC(C)=O)C(Cl)(Cl)Cl)[H]

Canonical SMILES

O=C(OC1=CC=C2C(=C1)CCC3C2CCC4(C)C(OC(OC(=O)C)C(Cl)(Cl)Cl)CCC34)C

Other Names for this Substance

  • Estra-1,3,5(10)-trien-3-ol, 17-[1-(acetyloxy)-2,2,2-trichloroethoxy]-, acetate, (17β)-
  • Estra-1,3,5(10)-trien-3-ol, 17β-(2,2,2-trichloro-1-hydroxyethoxy)-, diacetate
  • Cloxestradiol acetate
  • 17β-(2,2,2-Trichloro-1-hydroxyethoxy)estra-1,3,5(10)-trien-3-o1 diacetate
  • Genovul

CAS INSIGHTSTM
Targeted protein degrader structure, illustration