(16β)-Estra-1,3,5(10)-triene-3,16-diol

CAS Registry Number®

1225-58-7

CAS Name

(16β)-Estra-1,3,5(10)-triene-3,16-diol

Molecular Formula

C18H24O2

Molecular Mass

272.38

Cite this Page

(16β)-Estra-1,3,5(10)-triene-3,16-diol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1225-58-7 (retrieved 2024-12-22) (CAS RN: 1225-58-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    226.5-227 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H24O2/c1-18-7-6-15-14-5-3-12(19)8-11(14)2-4-16(15)17(18)9-13(20)10-18/h3,5,8,13,15-17,19-20H,2,4,6-7,9-10H2,1H3/t13-,15+,16+,17-,18+/m0/s1

InChIKey

InChIKey=DVMAUGGKVWJBDV-IREHDKGXSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@](C=4C(CC3)=CC(O)=CC4)(CC1)[H])[H])(C[C@H](O)C2)[H]

Canonical SMILES

OC1=CC=C2C(=C1)CCC3C2CCC4(C)CC(O)CC34

Other Names for this Substance

  • Estra-1,3,5(10)-triene-3,16-diol, (16β)-
  • Estra-1,3,5(10)-triene-3,16β-diol
  • (16β)-Estra-1,3,5(10)-triene-3,16-diol
  • 16β-Estradiol
  • 3,16β-Dihydroxyestra-1,3,5(10)-triene

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