![1H-Cyclopenta[a]phenanthren-3-one, 2-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]tetradecahydro-17-hydroxy-10,13-dimethyl-](/api/spectrum/B46FrHinpp2/structure.png?h=300&w=458 "1H-Cyclopenta[a]phenanthren-3-one, 2-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]tetradecahydro-17-hydroxy-10,13-dimethyl-")
| SpectraBase Compound ID | DC5h3a4pKcl |
|---|---|
| InChI | InChI=1S/C25H36N2O2/c1-15-17(14-26-27(15)4)11-16-13-25(3)18(12-22(16)28)5-6-19-20-7-8-23(29)24(20,2)10-9-21(19)25/h11,14,18-21,23,29H,5-10,12-13H2,1-4H3/b16-11- |
| InChIKey | HGOFOKBAWUKDED-WJDWOHSUSA-N |
| Mol Weight | 396.6 g/mol |
| Molecular Formula | C25H36N2O2 |
| Exact Mass | 396.277678 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B46FrHinpp2 |
|---|---|
| Name | 1H-Cyclopenta[a]phenanthren-3-one, 2-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]tetradecahydro-17-hydroxy-10,13-dimethyl- |
| Alternate Name(s) | (2Z)-2-[(1,5-dimethyl-4-pyrazolyl)methylidene]-17-hydroxy-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one (2Z)-2-[(1,5-dimethylpyrazol-4-yl)methylidene]-17-hydroxy-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one (2Z)-2-[(1,5-dimethylpyrazol-4-yl)methylidene]-10,13-dimethyl-17-oxidanyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H36N2O2 |
| InChI | InChI=1S/C25H36N2O2/c1-15-17(14-26-27(15)4)11-16-13-25(3)18(12-22(16)28)5-6-19-20-7-8-23(29)24(20,2)10-9-21(19)25/h11,14,18-21,23,29H,5-10,12-13H2,1-4H3/b16-11- |
| InChIKey | HGOFOKBAWUKDED-WJDWOHSUSA-N |
| Molecular Weight | 396.575 g/mol |
| SMILES | OC1C2(CCC3C(C2CC1)CCC1CC(\C(CC31C)=C/c1cn[n](c1C)C)=O)C |
| SPLASH | splash10-053i-4900000000-eb8a20f4bea1ba3f57a9 |
| Source of Spectrum | IY-1-4696-6 |
| Wiley ID | 1654949 |