| SpectraBase Spectrum ID |
43kYgK7c0W |
| Name |
Pregnan-20-one, 3,7-bis(acetyloxy)-12-hydroxy-, (3.alpha.,5.beta.,7.alpha.,12.alpha.)- |
| Alternate Name(s) |
(3alpha,7alpha,12alpha)-3-(acetyloxy)-12-hydroxy-20-oxopregnan-7-yl acetate
3.alpha.,7.alpha.-diacetoxy-12.alpha.-hydroxypregnan-20-one |
| CAS Registry Number |
63533-72-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H38O6 |
| InChI |
InChI=1S/C25H38O6/c1-13(26)18-6-7-19-23-20(12-22(29)25(18,19)5)24(4)9-8-17(30-14(2)27)10-16(24)11-21(23)31-15(3)28/h16-23,29H,6-12H2,1-5H3/t16?,17-,18-,19+,20+,21-,22+,23+,24+,25-/m1/s1 |
| InChIKey |
RCUSCARLAAAGEJ-QCVITDBQSA-N |
| Molecular Weight |
434.573 g/mol |
| SMILES |
O[C@@]1([C@]2([C@]([C@@]3([C@@](CC4[C@@]([C@]3(C1)[H])(CC[C@@](OC(=O)C)(C4)[H])C)(OC(=O)C)[H])[H])(CC[C@@]2(C(=O)C)[H])[H])C)[H] |
| SPLASH |
splash10-00fr-0096000000-c4e1a1a57d2648e2affb |
| Source of Spectrum |
O-13-406-2 |
| Wiley ID |
1382998 |
