SpectraBase Spectrum ID |
HFOSlSxcJGs |
Name |
20-Methyl-4,5-seco-pregnan-3,5-dione |
CAS Registry Number |
62015-52-5 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H36O2 |
InChI |
InChI=1S/C22H36O2/c1-14(2)17-7-8-18-16-6-9-20(24)22(5,12-10-15(3)23)19(16)11-13-21(17,18)4/h14,16-19H,6-13H2,1-5H3/t16-,17+,18-,19-,21+,22+/m0/s1 |
InChIKey |
KJDGVHVDFDHDGS-NTNOATJHSA-N |
Molecular Weight |
332.528 g/mol |
SMILES |
[C@@]12([C@]([C@@]3(CCC([C@@]([C@]3(CC2)[H])(CCC(=O)C)C)=O)[H])(CC[C@@]1(C(C)C)[H])[H])C |
SPLASH |
splash10-03di-0096000000-c8935fa3c9b9ee4cacff |
Source of Spectrum |
K-112-1612-0 |
Synonyms |
7H-Benz[e]inden-7-one, dodecahydro-3a,6-dimethyl-3-(1-methylethyl)-6-(3-oxobutyl)-, [3R-(3.alpha.,3a.alpha.,5a.beta.,6.beta.,9a.alpha.,9b.beta.)]-
(3R,3aR,5aS,6R,9aS,9bS)-3-isopropyl-3a,6-dimethyl-6-(3-oxobutyl)dodecahydro-7H-cyclopenta[a]naphthalen-7-one
20-Methyl-4,5-secopregnane-3,5-dione
3.beta.,20-dimethyl-8,14,-seco-a-nor-pregnan-8,14-dione |
Wiley ID |
1329929 |