| SpectraBase Spectrum ID |
KVTDiRjw9Bm |
| Name |
(8S,20R)-des-A,B-8-benzoyloxy-20-formylpregnane |
| Appearance |
Oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H26O3 |
| InChI |
InChI=1S/C20H26O3/c1-14(13-21)16-10-11-17-18(9-6-12-20(16,17)2)23-19(22)15-7-4-3-5-8-15/h3-5,7-8,13-14,16-18H,6,9-12H2,1-2H3/t14-,16+,17-,18-,20+/m0/s1 |
| InChIKey |
DCXYXPCMRLYABB-PIUDJOPYSA-N |
| Instrument Name |
Kratos DS-50 TC |
| Ionization Type |
EI |
| Molecular Weight |
314.425 g/mol |
| Optical Rotation |
[a]D = +28.8 (c = 0.88, CHCl3) |
| SMILES |
C1C[C@]2([C@@](CC[C@@]2([C@@](C)(C=O)[H])[H])([C@@](OC(=O)c2ccccc2)(C1)[H])[H])C |
| SPLASH |
splash10-0a6r-2900000000-3f9bf5997a01fd55740d |
| Source of Spectrum |
US7947666B2 |
| Wiley ID |
1861872 |
