| SpectraBase Spectrum ID |
lDyoIPqyG |
| Name |
Pregnan-3-one, 20-methyl-, (5.beta.,17.alpha.)- |
| Alternate Name(s) |
(1S,2S,7S,10R,11S,14S,15R)-2,15-dimethyl-14-(propan-2-yl)tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-5-one
20-Methyl-5.alpha.,17.alpha.-pregnan-3-one |
| CAS Registry Number |
72691-64-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H36O |
| InChI |
InChI=1S/C22H36O/c1-14(2)18-7-8-19-17-6-5-15-13-16(23)9-11-21(15,3)20(17)10-12-22(18,19)4/h14-15,17-20H,5-13H2,1-4H3/t15-,17-,18-,19-,20-,21-,22+/m0/s1 |
| InChIKey |
BITOYSGQNJZELQ-FQBUEQEESA-N |
| Molecular Weight |
316.529 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CCC(=O)C4)C)[H])[H])(CC[C@]1(C(C)C)[H])[H])C |
| SPLASH |
splash10-00lr-0097000000-23d287cbc35368ed118b |
| Source of Spectrum |
F-35-788-0 |
| Wiley ID |
1317395 |
