| SpectraBase Spectrum ID |
7xPCwftTmBI |
| Name |
Androst-5-ene-19-carbonitrile, 3-hydroxy-17-oxo-, (3.beta.)- |
| CAS Registry Number |
125632-13-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H27NO2 |
| InChI |
InChI=1S/C20H27NO2/c1-19-8-7-17-15(16(19)4-5-18(19)23)3-2-13-12-14(22)6-9-20(13,17)10-11-21/h2,14-17,22H,3-10,12H2,1H3/t14-,15-,16-,17-,19-,20+/m0/s1 |
| InChIKey |
KBWAPKUMDNXKSG-BUJXUYPKSA-N |
| Molecular Weight |
313.441 g/mol |
| SMILES |
O[C@]1(CC[C@]2(C(=CC[C@]3([C@@]4(CCC([C@]4(CC[C@]23[H])C)=O)[H])[H])C1)CC#N)[H] |
| SPLASH |
splash10-0udi-0091000000-8fd2857124bec32de939 |
| Source of Spectrum |
KC-1989-1653-9 |
| Synonyms |
19-Cyano-3.beta.-hydroxyandrost-5-en-17-one
2-[(1S,2S,5S,10R,11S,15S)-5-hydroxy-15-methyl-14-oxotetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-2-yl]acetonitrile |
| Wiley ID |
1314432 |
