| SpectraBase Compound ID | 2cqthwzAvjw |
|---|---|
| InChI | InChI=1S/C27H47NO2/c1-16-5-8-23(28-15-16)17(2)25-24(30)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h16-25,28-30H,5-15H2,1-4H3/t16-,17?,18?,19?,20?,21?,22?,23+,24?,25?,26?,27?/m1/s1 |
| InChIKey | PNCADIYJKRZFGU-GJMLIGMBSA-N |
| Mol Weight | 417.7 g/mol |
| Molecular Formula | C27H47NO2 |
| Exact Mass | 417.36068 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 780PuYvWOmp |
|---|---|
| Name | 16,28-Secosolanidane-3,16-diol, (3.beta.,5.alpha.,16.beta.,22.xi.,25.xi.)- |
| Alternate Name(s) | 20-(5-Methyl-2-piperidinyl)pregnane-3,16-diol 10,13-dimethyl-17-[1-(5-methyl-2-piperidinyl)ethyl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol 16-iso-Tetrahydro-solasodine 10,13-dimethyl-17-[1-(5-methyl-2-piperidyl)ethyl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol 10,13-dimethyl-17-[1-(5-methylpiperidin-2-yl)ethyl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol 5,6,22,16(O)-Tetrahydrosolasodine 5,6,22,O-Tetrahydrosolasodine stereoisomer Dihydrotomatidine Dihydrotomatodine A Tomatidine, dihydro- |
| CAS Registry Number | 1449-16-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H47NO2 |
| InChI | InChI=1S/C27H47NO2/c1-16-5-8-23(28-15-16)17(2)25-24(30)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h16-25,28-30H,5-15H2,1-4H3/t16-,17?,18?,19?,20?,21?,22?,23+,24?,25?,26?,27?/m1/s1 |
| InChIKey | PNCADIYJKRZFGU-GJMLIGMBSA-N |
| Molecular Weight | 417.678 g/mol |
| SMILES | N1C[C@@](CC[C@]1(C(C1C2(C(CC1O)C1C(CC2)C2(C(CC1)CC(CC2)O)C)C)C)[H])(C)[H] |
| SPLASH | splash10-0002-9100000000-c66c00ed573f0e923c23 |
| Source of Spectrum | NP-14-8202-0 |
| Wiley ID | 1112019 |