| SpectraBase Compound ID | JuGACErBtkb |
|---|---|
| InChI | InChI=1S/C28H42O2/c1-18(2)19(3)11-16-28(6,30)25-10-9-23-22-8-7-20-17-21(29)12-14-26(20,4)24(22)13-15-27(23,25)5/h12,14,17-18,22-25,30H,3,7-11,13,15-16H2,1-2,4-6H3/t22?,23?,24?,25-,26-,27-,28-/m0/s1 |
| InChIKey | POHAELYSNDHUQG-AEPVTUDPSA-N |
| Mol Weight | 410.6 g/mol |
| Molecular Formula | C28H42O2 |
| Exact Mass | 410.318481 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 | GKOLXXq4my8 |
|---|---|
| Name | (20S)-20-Hydroxyergosta-1,4,24(28)-trien-3-one |
| Alternate Name(s) | 20-hydroxyergosta-1,4,24(28)-trien-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H42O2 |
| InChI | InChI=1S/C28H42O2/c1-18(2)19(3)11-16-28(6,30)25-10-9-23-22-8-7-20-17-21(29)12-14-26(20,4)24(22)13-15-27(23,25)5/h12,14,17-18,22-25,30H,3,7-11,13,15-16H2,1-2,4-6H3/t22?,23?,24?,25-,26-,27-,28-/m0/s1 |
| InChIKey | POHAELYSNDHUQG-AEPVTUDPSA-N |
| Molecular Weight | 410.642 g/mol |
| SMILES | O[C@]([C@@]1([C@]2(CCC3[C@@]4(C(=CC(C=C4)=O)CCC3C2CC1)C)C)[H])(CCC(=C)C(C)C)C |
| SPLASH | splash10-001i-9000000000-955c2242fb60ffa4af77 |
| Source of Spectrum | X2-68-1114-4 |
| Wiley ID | 1609629 |