| SpectraBase Spectrum ID |
khaLNZPWmJ |
| Name |
Tetrahydrogestrinone |
| Alternate Name(s) |
THG
13.beta.,17.alpha.-diethyl-17.beta.-hydroxygon-4,9,11-trien-3-one
(8S,13S,14S,17S)-13,17-diethyl-17-hydroxy-1,2,6,7,8,13,14,15,16,17-decahydro-3H-cyclopenta[a]phenanthren-3-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H28O2 |
| InChI |
InChI=1S/C21H28O2/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h9,11,13,18-19,23H,3-8,10,12H2,1-2H3/t18-,19+,20+,21+/m1/s1 |
| InChIKey |
OXHNQTSIKGHVBH-ANULTFPQSA-N |
| Molecular Weight |
312.453 g/mol |
| SMILES |
O[C@]1(CC[C@]2([C@@]3(CCC4=CC(CCC4=C3C=C[C@]12CC)=O)[H])[H])CC |
| SPLASH |
splash10-004l-3950000000-987d670616efe97594e6 |
| Source of Spectrum |
SWG-33-2683-0 |
| Wiley ID |
1809749 |
