| SpectraBase Spectrum ID |
A5gvFAw4Lil |
| Name |
d3-cortisol |
| Alternate Name(s) |
11,17,21-Trihydroxy-9,12,12-trideuteriopregn-4-ene-3,20-dione
9,12,12-Trideuteriohydrocortisone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H27D3O5 |
| InChI |
InChI=1S/C21H30O5/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/h9,14-16,18,22,24,26H,3-8,10-11H2,1-2H3/t14-,15-,16?,18+,19-,20-,21-/m0/s1/i10D2,18D |
| InChIKey |
JYGXADMDTFJGBT-SFRCRWLTSA-N |
| Molecular Weight |
365.484 g/mol |
| SMILES |
OCC([C@@]1([C@@]2([C@]([C@@]3(CCC=4[C@@]([C@]3(C(C2([2D])[2D])O)[2D])(CCC(=O)C4)C)[H])(CC1)[H])C)O)=O |
| SPLASH |
splash10-025i-2943000000-853dacdbc057988b44f3 |
| Source of Spectrum |
KO-18-664-1 |
| Wiley ID |
1349755 |
