| SpectraBase Compound ID | 5PGQBqPhv29 |
|---|---|
| InChI | InChI=1S/C25H42O6/c1-16(26)30-14-17(27)15-31-21(28)20-24(5)12-8-18-22(2,3)10-7-11-23(18,4)19(24)9-13-25(20,6)29/h17-20,27,29H,7-15H2,1-6H3/t17-,18+,19-,20+,23+,24-,25-/m0/s1 |
| InChIKey | MVBVSKIJDOZAPB-KOUISDIFSA-N |
| Mol Weight | 438.6 g/mol |
| Molecular Formula | C25H42O6 |
| Exact Mass | 438.298139 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4jPufQjm5qS |
|---|---|
| Name | ANISODORIN-3 |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H42O6 |
| InChI | InChI=1S/C25H42O6/c1-16(26)30-14-17(27)15-31-21(28)20-24(5)12-8-18-22(2,3)10-7-11-23(18,4)19(24)9-13-25(20,6)29/h17-20,27,29H,7-15H2,1-6H3/t17-,18+,19-,20+,23+,24-,25-/m0/s1 |
| InChIKey | MVBVSKIJDOZAPB-KOUISDIFSA-N |
| Literature Reference Author | M.GAVAGNIN,N.UNGUR,F.CASTELLUCCIO,C.MUNIAIN,G.CIMINO |
| Literature Reference Citation | J.NAT.PROD.,62,269(1999) |
| Literature Reference DOI | 10.1021/np980344r |
| Molecular Weight | 438.605 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWGE1194 |