Sodium (3α,13α,14β)-17-oxoestra-5(10),6,8-trien-3-yl sulfate

More details:

• Systematic name

  Sodium (3alpha,13alpha,14beta)-17-oxoestra-5(10),6,8-trien-3-yl sulfate

• SMILES

  [Na+].C[C@@]12CCC3=C(C=CC4C[C@@H](CCC3=4)OS([O-])(=O)=O)[C@H]1CCC2=O

• Std. InChi

  InChI=1S/C18H22O5S.Na/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19;/h2,4,12,16H,3,5-10H2,1H3,(H,20,21,22);/q;+1/p-1/t12-,16-,18-;/m1./s1

• Std. InChIKey

  WBKQGCGMVRDFRA-QAKMBFBESA-M

• Cite this record

  CSID:114565964, http://www.chemspider.com/Chemical-Structure.114565964.html (accessed 07:00, May 21, 2024)