| SpectraBase Spectrum ID |
EZUjeT5XVhK |
| Name |
13-(1',3'-Dioxolan-2'-yl)-3.beta.-hydroxy-16,17-seco-17-nor-androst-5-ene-16-nitrile |
| Alternate Name(s) |
2-[(2S,4bR,7S)-2-(1,3-dioxolan-2-yl)-2,4b-dimethyl-7-oxidanyl-1,3,4,4a,5,6,7,8,10,10a-decahydrophenanthren-1-yl]ethanenitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H31NO3 |
| InChI |
InChI=1S/C21H31NO3/c1-20-8-5-15(23)13-14(20)3-4-16-17(20)6-9-21(2,18(16)7-10-22)19-24-11-12-25-19/h3,15-19,23H,4-9,11-13H2,1-2H3/t15-,16?,17?,18?,20-,21-/m0/s1 |
| InChIKey |
VPFJTBNYIXAHMP-KJBVPOJVSA-N |
| Molecular Weight |
345.483 g/mol |
| SMILES |
O[C@]1(CC[C@]2(C(=CCC3C2CC[C@@](C2OCCO2)(C)C3CC#N)C1)C)[H] |
| SPLASH |
splash10-00di-9000000000-ad30180c2597e6a8305e |
| Source of Spectrum |
G-73-628-2 |
| Wiley ID |
1693178 |
