(11β)-11,18,21-Trihydroxy(2,2,4,6,6,17,21,21-²H₈)pregn-4-ene-3,20-dione

More details:

• Systematic name

  (11beta)-11,18,21-Trihydroxy(2,2,4,6,6,17,21,21-~2~H_8_)pregn-4-ene-3,20-dione

• SMILES

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

• Std. InChi

  InChI=1S/C21H30O5/c1-20-7-6-13(24)8-12(20)2-3-14-15-4-5-16(18(26)10-22)21(15,11-23)9-17(25)19(14)20/h8,14-17,19,22-23,25H,2-7,9-11H2,1H3/t14-,15-,16+,17-,19+,20-,21+/m0/s1/i2D2,6D2,8D,10D2,16D

• Std. InChIKey

  HFSXHZZDNDGLQN-IQMRVCOUSA-N

• Cite this record

  CSID:58783257, http://www.chemspider.com/Chemical-Structure.58783257.html (accessed 07:39, Apr 16, 2024)