| SpectraBase Compound ID | 5aej000knmH |
|---|---|
| InChI | InChI=1S/C24H36O6/c1-5-7-17(25)28-16-12-15-22(2,3)10-6-11-23(15,4)14-9-8-13-18-20(29-19(13)26)30-21(27)24(14,16)18/h13-16,18,20-21,27H,5-12H2,1-4H3/t13-,14?,15?,16-,18+,20+,21-,23-,24-/m1/s1 |
| InChIKey | VDGDSNQYFYXHGB-GZXRLDMESA-N |
| Mol Weight | 420.5 g/mol |
| Molecular Formula | C24H36O6 |
| Exact Mass | 420.251189 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CoemeLLiiNH |
|---|---|
| Name | (-)-7-ALPHA-BUTYROXY-17-BETA-HYDROXY-15-BETA,17-EPOXYSPONGIAN-16-ONE;APLYROSEOL-1 |
| Compound Number | 19 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H36O6 |
| InChI | InChI=1S/C24H36O6/c1-5-7-17(25)28-16-12-15-22(2,3)10-6-11-23(15,4)14-9-8-13-18-20(29-19(13)26)30-21(27)24(14,16)18/h13-16,18,20-21,27H,5-12H2,1-4H3/t13-,14?,15?,16-,18+,20+,21-,23-,24-/m1/s1 |
| InChIKey | VDGDSNQYFYXHGB-GZXRLDMESA-N |
| Literature Reference Author | A.ABAD,M.ARNO,M.L.MARIN,R.J.ZARAGOZA |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,1861(1993) |
| Literature Reference DOI | 10.1039/p19930001861 |
| Molecular Weight | 420.546 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP7336 |