| SpectraBase Compound ID | 9NdxPNJtHac |
|---|---|
| InChI | InChI=1S/C22H28O8/c1-12(7-8-23)21(26)29-19-10-16(11-24)5-6-17(28-15(4)25)13(2)9-18-20(19)14(3)22(27)30-18/h5,7,9,17-20,23-24H,3,6,8,10-11H2,1-2,4H3/b12-7+,13-9+,16-5-/t17-,18+,19+,20-/m0/s1 |
| InChIKey | INXZZSZBRLXKNT-YTLIWXSPSA-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 | 6lXEXJQRZIY |
|---|---|
| Name | 3-BETA-ACETOXY-8-BETA-(4'-HYDROXY-TIGLOYLOXY)-14-HYDROXY-COSTUNOLIDE |
| Compound Number | 4A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H28O8 |
| InChI | InChI=1S/C22H28O8/c1-12(7-8-23)21(26)29-19-10-16(11-24)5-6-17(28-15(4)25)13(2)9-18-20(19)14(3)22(27)30-18/h5,7,9,17-20,23-24H,3,6,8,10-11H2,1-2,4H3/b12-7+,13-9+,16-5-/t17-,18+,19+,20-/m0/s1 |
| InChIKey | INXZZSZBRLXKNT-YTLIWXSPSA-N |
| Literature Reference Author | L.R.HERNANDEZ,C.A.N.CATALAN,C.M.CERDA-GARCIA-ROJAS,P.JOSEPH- NATHAN |
| Literature Reference Citation | PHYTOCHEM.,37,1331(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)90408-4 |
| Molecular Weight | 420.460 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS23511 |