| SpectraBase Spectrum ID |
JO7fHnemfaL |
| Name |
20-Carbonitrile-3.beta.-hydroxypregn-5-ene |
| CAS Registry Number |
50303-63-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H33NO |
| InChI |
InChI=1S/C22H33NO/c1-14(13-23)18-6-7-19-17-5-4-15-12-16(24)8-10-21(15,2)20(17)9-11-22(18,19)3/h4,14,16-20,24H,5-12H2,1-3H3/t14?,16-,17-,18+,19-,20-,21-,22+/m0/s1 |
| InChIKey |
MKLILGROSVKRQG-GAJWHHLVSA-N |
| Molecular Weight |
327.512 g/mol |
| SMILES |
O[C@]1(CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC=C2C1)[H])(CC[C@@]4(C(C#N)C)[H])[H])C)[H])C)[H] |
| SPLASH |
splash10-014i-0977000000-20830ef8505a9d6cd1ed |
| Source of Spectrum |
J-41-1874-0 |
| Synonyms |
2-[(1S,2R,5S,10S,11S,14R,15S)-5-hydroxy-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-14-yl]propanenitrile
Pregnolone |
| Wiley ID |
1325760 |
