| SpectraBase Compound ID | EdLdUMLLYKd |
|---|---|
| InChI | InChI=1S/C20H30O2/c1-12-10-13-11-14(21)4-5-15(13)16-6-8-19(2)17(18(12)16)7-9-20(19,3)22/h11-12,15-18,22H,4-10H2,1-3H3/t12-,15+,16-,17+,18-,19+,20+/m1/s1 |
| InChIKey | PTQMMNYJKCSPET-OMHQDGTGSA-N |
| Mol Weight | 302.46 g/mol |
| Molecular Formula | C20H30O2 |
| Exact Mass | 302.22458 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5Kt5GaESPi |
|---|---|
| Name | Mibolerone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H30O2 |
| InChI | InChI=1S/C20H30O2/c1-12-10-13-11-14(21)4-5-15(13)16-6-8-19(2)17(18(12)16)7-9-20(19,3)22/h11-12,15-18,22H,4-10H2,1-3H3/t12-,15+,16-,17+,18-,19+,20+/m1/s1 |
| InChIKey | PTQMMNYJKCSPET-OMHQDGTGSA-N |
| Molecular Weight | 302.458 g/mol |
| SMILES | O[C@]1(CC[C@]2([C@@]3([C@@](CC4=CC(CC[C@@]4([C@]3(CC[C@]12C)[H])[H])=O)(C)[H])[H])[H])C |
| SPLASH | splash10-0536-5940000000-d0d4125e30a7600d600c |
| Source of Spectrum | SWG-33-1328-0 |
| Synonyms | 17.beta.-Hydroxy-7.alpha.,17-dimethylestr-4-en-3-one (7R,8R,9S,10R,13S,14S,17S)-17-hydroxy-7,13,17-trimethyl-1,2,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-3H-cyclopenta[a]phenanthren-3-one |
| Wiley ID | 1809131 |