17,21-Dihydroxy(2,2,4,6,6,9,12,12,21,21-²H₁₀)pregn-4-ene-3,11,20-trione

More details:

• Systematic name

  17,21-Dihydroxy(2,2,4,6,6,9,12,12,21,21-~2~H_10_)pregn-4-ene-3,11,20-trione

• SMILES

  C[C@@]12CC([2H])([2H])C(=O)C([2H])=C2C([2H])([2H])C[C@H]3[C@@H]4CC[C@](C(=O)C([2H])([2H])O)([C@@]4(C)C([2H])([2H])C(=O)[C@@]31[2H])O [2H]C1=C2[C@](CC(C1=O)([2H])[2H])([C@@]3([C@@H](CC2([2H])[2H])[C@@H]4CC[C@@]([C@]4(C(C3=O)([2H])[2H])C)(C(=O)C([2H])([2H])O)O)[2H])C

• Std. InChi

  InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,14-15,18,22,26H,3-8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1/i3D2,5D2,9D,10D2,11D2,18D

• Std. InChIKey

  MFYSYFVPBJMHGN-IFBQEKQHSA-N

• Cite this record

  CSID:58779734, http://www.chemspider.com/Chemical-Structure.58779734.html (accessed 15:34, Apr 25, 2024)