| SpectraBase Spectrum ID |
ALf9Z4wbmwK |
| Name |
3.alpha.,20.beta.-Dihydroxy-5.beta.-C-homo-11-oxapregnan-12-one |
| Alternate Name(s) |
(2R,12aR)-2-hydroxy-8-[(1S)-1-hydroxyethyl]-4a,7a-dimethylhexadecahydro-7H-cyclopenta[c]naphtho[2,1-e]oxepin-7-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H34O4 |
| InChI |
InChI=1S/C21H34O4/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)18(15)11-25-19(24)21(16,17)3/h12-18,22-23H,4-11H2,1-3H3/t12-,13+,14+,15?,16?,17?,18?,20?,21?/m0/s1 |
| InChIKey |
QLXPPCZPFOBTRX-JQXFEVLESA-N |
| Molecular Weight |
350.499 g/mol |
| SMILES |
O[C@@]1(CCC2(C3C(C4C(C([C@@](O)(C)[H])CC4)(C(OC3)=O)C)CC[C@@]2(C1)[H])C)[H] |
| SPLASH |
splash10-008c-5009000000-f38a295147034197b19b |
| Source of Spectrum |
AJ-62-195-5 |
| Wiley ID |
1342155 |
