β-Dihydroequilin

CAS Registry Number®

3563-27-7

CAS Name

β-Dihydroequilin

Molecular Formula

C18H22O2

Molecular Mass

270.37

Cite this Page

β-Dihydroequilin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3563-27-7 (retrieved 2024-11-21) (CAS RN: 3563-27-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    174.5 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3-5,10,14,16-17,19-20H,2,6-9H2,1H3/t14-,16+,17+,18+/m1/s1

InChIKey

InChIKey=NLLMJANWPUQQTA-UBDQQSCGSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Estra-1,3,5(10),7-tetraene-3,17-diol, (17β)-
  • Estra-1,3,5(10),7-tetraene-3,17β-diol
  • (17β)-Estra-1,3,5(10),7-tetraene-3,17-diol
  • 17β-Dihydroequilin
  • β-Dihydroequilin

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration