| SpectraBase Compound ID | 9xkUMc5XpA7 |
|---|---|
| InChI | InChI=1S/C22H28O8/c1-5-12(2)21(26)28-11-15-6-17(29-14(4)24)8-16(10-23)19(25)9-18-13(3)22(27)30-20(18)7-15/h7-8,12,17-18,20,23H,3,5-6,9-11H2,1-2,4H3/b15-7-,16-8+/t12?,17-,18-,20+/m0/s1 |
| InChIKey | LTIMCRDLRYFHGE-CAURJECCSA-N |
| Mol Weight | 420.46 g/mol |
| Molecular Formula | C22H28O8 |
| Exact Mass | 420.178418 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 430gYNyb8LG |
|---|---|
| Name | 2-ALPHA-ACETOXY-15-(2-METHYLBUTYRYL)-MIGUANIN;8-ALPHA-ACETOXY-14-HYDROXY-15-(2-METHYLBUTYRYLOXY)-9-OXO-COSTUNOLIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H28O8 |
| InChI | InChI=1S/C22H28O8/c1-5-12(2)21(26)28-11-15-6-17(29-14(4)24)8-16(10-23)19(25)9-18-13(3)22(27)30-20(18)7-15/h7-8,12,17-18,20,23H,3,5-6,9-11H2,1-2,4H3/b15-7-,16-8+/t12?,17-,18-,20+/m0/s1 |
| InChIKey | LTIMCRDLRYFHGE-CAURJECCSA-N |
| Literature Reference Author | P.RUENGELER,V.BRECHT,G.TAMAYO-CASTILLO,I.MERFORT |
| Literature Reference Citation | PHYTOCHEM.,56,475(2001) |
| Literature Reference DOI | 10.1016/S0031-9422(00)00394-0 |
| Molecular Weight | 420.460 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN1794 |