| SpectraBase Spectrum ID |
Ig5SpeYCxUI |
| Name |
Androstane-3,17-diol, 17-acetate 3-(trifluoroacetate), (3.alpha.,5.alpha.,17.beta.)- |
| CAS Registry Number |
51525-79-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H33F3O4 |
| InChI |
InChI=1S/C23H33F3O4/c1-13(27)29-19-7-6-17-16-5-4-14-12-15(30-20(28)23(24,25)26)8-10-21(14,2)18(16)9-11-22(17,19)3/h14-19H,4-12H2,1-3H3/t14-,15+,16-,17-,18-,19-,21-,22-/m0/s1 |
| InChIKey |
TWOBSMHIPYPENN-GRCXZVSFSA-N |
| Molecular Weight |
430.508 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CC[C@@](OC(C(F)(F)F)=O)(C4)[H])C)[H])[H])(CC[C@@]1(OC(=O)C)[H])[H])C |
| SPLASH |
splash10-0002-0925000000-951a389f2c6c087ed2bf |
| Source of Spectrum |
JC-88-278-4 |
| Synonyms |
(3alpha,5alpha,17beta)-17-(acetyloxy)androstan-3-yl trifluoroacetate
3.alpha.-hydroxy-17.beta.-acetoxy-5.alpha.-androstane 1-trifluoroacetyl derivative |
| Wiley ID |
1381523 |
