| SpectraBase Compound ID | GgoJc4RBEZb |
|---|---|
| InChI | InChI=1S/C31H40O10/c1-16-10-25(39-17(2)33)31(36)27(38-16)40-23-12-19-4-5-22-21(29(19,15-32)13-24(23)41-31)6-8-28(3)20(7-9-30(22,28)35)18-11-26(34)37-14-18/h4,11,15-16,20-25,27,35-36H,5-10,12-14H2,1-3H3/t16-,20-,21+,22-,23-,24-,25+,27+,28-,29-,30+,31+/m1/s1 |
| InChIKey | KBQLSJYNUUELHO-LAVUZKRISA-N |
| Mol Weight | 572.7 g/mol |
| Molecular Formula | C31H40O10 |
| Exact Mass | 572.262147 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BdSqAVEWihO |
|---|---|
| Name | 5,6-DEHYDROASCLEPIN |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H40O10 |
| InChI | InChI=1S/C31H40O10/c1-16-10-25(39-17(2)33)31(36)27(38-16)40-23-12-19-4-5-22-21(29(19,15-32)13-24(23)41-31)6-8-28(3)20(7-9-30(22,28)35)18-11-26(34)37-14-18/h4,11,15-16,20-25,27,35-36H,5-10,12-14H2,1-3H3/t16-,20-,21+,22-,23-,24-,25+,27+,28-,29-,30+,31+/m1/s1 |
| InChIKey | KBQLSJYNUUELHO-LAVUZKRISA-N |
| Literature Reference Author | R.A.MARTIN,S.P.LYNCH,F.J.SCHMITZ,E.O.PORDESIMO,S.TOTH,R.Y.HO RTON |
| Literature Reference Citation | PHYTOCHEM.,30,3935(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)83439-R |
| Molecular Weight | 572.653 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU28152 |