3,20-Dioxopregn-4-en-21-yl 2,2-bis[(²H₃)methyl](²H₃)propanoate

More details:

• Systematic name

  3,20-Dioxopregn-4-en-21-yl 2,2-bis[(~2~H_3_)methyl](~2~H_3_)propanoate

• SMILES

  C([2H])([2H])([2H])C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C(=O)OCC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C [2H]C([2H])([2H])C(C(=O)OCC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C)(C([2H])([2H])[2H])C([2H])([2H])[2H]

• Std. InChi

  InChI=1S/C26H38O4/c1-24(2,3)23(29)30-15-22(28)21-9-8-19-18-7-6-16-14-17(27)10-12-25(16,4)20(18)11-13-26(19,21)5/h14,18-21H,6-13,15H2,1-5H3/t18-,19-,20-,21+,25-,26-/m0/s1/i1D3,2D3,3D3

• Std. InChIKey

  VVOIQBFMTVCINR-XUFLEOPMSA-N

• Cite this record

  CSID:58781520, http://www.chemspider.com/Chemical-Structure.58781520.html (accessed 21:03, Jul 5, 2024)