Try beta.chemspider
- 7 of 7 defined stereocentres
- Non-standard isotope
(11beta)-11,17,21-Trihydroxy(9,11,12,12-~2~H_4_)pregna-4,6-diene-3,20-dione
C[C@@]12CCC(=O)C=C2C=C[C@H]3[C@@H]4CC[C@](C(=O)CO)([C@@]4(C)C([2H])([2H])[C@@]([2H])([C@@]31[2H])O)O [2H][C@]12[C@@H](C=CC3=CC(=O)CC[C@@]31C)[C@@H]4CC[C@@]([C@]4(C([C@]2([2H])O)([2H])[2H])C)(C(=O)CO)O
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/h3-4,9,14-16,18,22,24,26H,5-8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1/i10D2,16D,18D
IFOXVSBZLASBJM-BJJKTIQHSA-N
CSID:58780570, http://www.chemspider.com/Chemical-Structure.58780570.html (accessed 01:45, Jul 9, 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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