| SpectraBase Compound ID | 7ia2zt6ifNF |
|---|---|
| InChI | InChI=1S/C28H44O3/c1-17(2)18(3)9-14-28(6,31)25-24(30)16-23-21-8-7-19-15-20(29)10-12-26(19,4)22(21)11-13-27(23,25)5/h7,17,20-23,25,29,31H,3,8-16H2,1-2,4-6H3/t20-,21+,22-,23-,25-,26-,27-,28?/m0/s1 |
| InChIKey | NPINYZPYWQAICW-BCEDFZBNSA-N |
| Mol Weight | 428.7 g/mol |
| Molecular Formula | C28H44O3 |
| Exact Mass | 428.329045 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ITwrEnJhNZa |
|---|---|
| Name | (2OS)-3-BETA,20-DIHYDROXYERGOSTA-5,24(28)-DIEN-16-ONE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H44O3 |
| InChI | InChI=1S/C28H44O3/c1-17(2)18(3)9-14-28(6,31)25-24(30)16-23-21-8-7-19-15-20(29)10-12-26(19,4)22(21)11-13-27(23,25)5/h7,17,20-23,25,29,31H,3,8-16H2,1-2,4-6H3/t20-,21+,22-,23-,25-,26-,27-,28?/m0/s1 |
| InChIKey | NPINYZPYWQAICW-BCEDFZBNSA-N |
| Literature Reference Author | B.BIAN,I.A.VANALTENA |
| Literature Reference Citation | AUSTR.J.CHEM.,51,1157(1998) |
| Literature Reference DOI | 10.1071/C98008 |
| Molecular Weight | 428.656 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS21841 |