Substance
  • Substance Name: (17beta)-estra-1,3,5(10)-triene-3,17diol
  • Formula: C18H24O2
  • Molecular Weight: 272.4 g/mol
  • Identifiers:
    • casrn: 50-28-2
    • pubchemId: 5757
    • iupacname: (8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
    • inchi: InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1
    • inchikey: VOXZDWNPVJITMN-ZBRFXRBCSA-N
    • csmiles: CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)O
    • ismiles: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)O
    • wikidataId: Q422416
    • chemspiderId: 5554
    • dsstoxcmpId: DTXCID80573
    • chemblId: CHEMBL135
    • ecnumber: 200-023-8
(17beta)-estra-1,3,5(10)-triene-3,17diol
Systems and Datasets