| SpectraBase Compound ID | 1d1w0MS4Vlf |
|---|---|
| InChI | InChI=1S/C27H47NO/c1-17-13-20(28-16-17)14-18(2)23-7-8-24-22-6-5-19-15-21(29)9-11-26(19,3)25(22)10-12-27(23,24)4/h17-25,28-29H,5-16H2,1-4H3 |
| InChIKey | FIBLCOJJCDLBGE-UHFFFAOYSA-N |
| Mol Weight | 401.7 g/mol |
| Molecular Formula | C27H47NO |
| Exact Mass | 401.365765 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Eu26NirnAe1 |
|---|---|
| Name | Tetrahydro-22-desoxy-tomatillidine |
| CAS Registry Number | 984-81-6 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H47NO |
| InChI | InChI=1S/C27H47NO/c1-17-13-20(28-16-17)14-18(2)23-7-8-24-22-6-5-19-15-21(29)9-11-26(19,3)25(22)10-12-27(23,24)4/h17-25,28-29H,5-16H2,1-4H3 |
| InChIKey | FIBLCOJJCDLBGE-UHFFFAOYSA-N |
| Molecular Weight | 401.679 g/mol |
| SMILES | OC1CCC2(C3CCC4(C(CCC4C(CC4CC(CN4)C)C)C3CCC2C1)C)C |
| SPLASH | splash10-0002-9000000000-474f36c5cefe0c61b16b |
| Source of Spectrum | NP-14-5093-0 |
| Synonyms | 10,13-dimethyl-17-[1-(4-methyl-2-pyrrolidinyl)propan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol 10,13-dimethyl-17-[1-(4-methylpyrrolidin-2-yl)propan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol |
| Wiley ID | 1111808 |