| SpectraBase Spectrum ID |
3QCt9wA8O9G |
| Name |
17.beta.-Acetoxy-4,5.alpha.-epoxyandrostane |
| Alternate Name(s) |
(4aR,4bS,6aS,7S,9aS,9bS,11aS)-4a,6a-dimethylhexadecahydrocyclopenta[7,8]phenanthro[1,10a-b]oxiren-7-yl acetate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H32O3 |
| InChI |
InChI=1S/C21H32O3/c1-13(22)23-17-7-6-15-14-8-12-21-18(24-21)5-4-10-20(21,3)16(14)9-11-19(15,17)2/h14-18H,4-12H2,1-3H3/t14-,15-,16-,17-,18?,19-,20+,21+/m0/s1 |
| InChIKey |
KCNFNMNXNSDYER-TUXYUONUSA-N |
| Molecular Weight |
332.484 g/mol |
| SMILES |
C1CC[C@]2([C@]3(C1O3)CC[C@]1([C@@]3(CC[C@@]([C@@]3(C)CC[C@]21[H])(OC(=O)C)[H])[H])[H])C |
| SPLASH |
splash10-001i-0009000000-493bcc5a526e2facb733 |
| Source of Spectrum |
K1-2004-4786-1 |
| Wiley ID |
1562020 |
