Equilin, acetate

CAS Registry Number®

43085-97-8

CAS Name

Equilin, acetate

Molecular Formula

C20H22O3

Molecular Mass

310.39

Cite this Page

Equilin, acetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=43085-97-8 (retrieved 2024-11-24) (CAS RN: 43085-97-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H22O3/c1-12(21)23-14-4-6-15-13(11-14)3-5-17-16(15)9-10-20(2)18(17)7-8-19(20)22/h4-6,11,16,18H,3,7-10H2,1-2H3/t16-,18+,20+/m1/s1

InChIKey

InChIKey=DBXQAPGFWYIOGN-KPFFTGBYSA-N

SMILES

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

Canonical SMILES

O=C(OC1=CC=C2C(=C1)CC=C3C2CCC4(C(=O)CCC34)C)C

Other Names for this Substance

  • Estra-1,3,5(10),7-tetraen-17-one, 3-(acetyloxy)-
  • 3-(Acetyloxy)estra-1,3,5(10),7-tetraen-17-one
  • Equilin-3-acetate
  • Equilin, acetate

Deleted or Replaced CAS Registry Numbers

909269-86-9

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