(16beta)-3,16-Dihydroxyestra-1,3,5(10)-trien-17-one | CAS No. 966-06-3

(16beta)-3,16-Dihydroxyestra-1,3,5(10)-trien-17-one

Basic Information

CAS Number

966-06-3

Molecular Formula

C18H22O3

Molecular Weight

286.37 g/mol

AD

Basic Physical Properties

CC12CCC3C(C1CC(C2=O)O)CCC4=C3C=CC(=C4)O

InChI

InChI=1S/C18H22O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-16,19-20H,2,4,6-7,9H2,1H3/t13-,14-,15+,16+,18+/m1/s1

InChIKey

WPOCIZJTELRQMF-LFRCEIEQSA-N

LogP

2.7882000000000016

Topological Polar Surface Area

57.53 Ų

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

448

Synonyms & References

English

  • (16beta)-3,16-dihydroxyestra-1,3,5(10)-trien-17-one
  • SCHEMBL224256
  • 966-06-3
  • 16b-Hydroxyestrone
  • LMST02010046
  • 16beta-Hydroxyestrone
  • 3,16-dihydroxy-Estra-1,3,5(10)-trien-17-one
  • CHEBI:87628
  • CHEMBL1908079
  • DTXSID301316033
  • 3,16-Dihydroxyestra-1,3,5(10)-trien-17-one
  • 3,16beta-dihydroxy-estra-1,3,5(10)-trien-17-one
  • Q27159788
  • 3,16beta-dihydroxyestra-1,3,5(10)-trien-17-one
  • Estra-1,3,5(10)-trien-17-one,3,16-dihydroxy-, (16b)-
  • (8R,9S,13S,14S)-3,16-dihydroxy-13-methyl-7,8,9,11,12,14,15,16 octahydro-6H-cyclopenta[a]phenanthren-17-one

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