- 6 of 7 defined stereocentres
- Non-standard isotope
(8xi,11beta)-11,17,21-Trihydroxy(2,4,6,6,9,11,12,12-~2~H_8_)pregna-1,4-diene-3,20-dione
C[C@@]12C=C([2H])C(=O)C([2H])=C2C([2H])([2H])CC3[C@@H]4CC[C@](C(=O)CO)([C@@]4(C)C([2H])([2H])[C@@]([2H])([C@@]31[2H])O)O [2H]C1=C[C@]2(C(=C(C1=O)[2H])C(CC3[C@@]2([C@@](C([C@]4([C@H]3CC[C@@]4(C(=O)CO)O)C)([2H])[2H])([2H])O)[2H])([2H])[2H])C
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/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14?,15-,16-,18+,19-,20-,21-/m0/s1/i3D2,5D,9D,10D2,16D,18D
OIGNJSKKLXVSLS-DAJRSGRQSA-N
CSID:58785027, http://www.chemspider.com/Chemical-Structure.58785027.html (accessed 11:21, Mar 29, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
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