| SpectraBase Compound ID | HSoF1jWvPLP |
|---|---|
| InChI | InChI=1S/C33H50O5/c1-20(34)38-25-12-13-30(6)24-11-10-21-22-18-28(2,3)14-16-33(22,27(36)37-9)17-15-31(21,7)32(24,8)19-23(35)26(30)29(25,4)5/h10,22,24-26H,11-19H2,1-9H3/t22?,24?,25-,26?,30+,31+,32+,33-/m0/s1 |
| InChIKey | AXKBLMKSCAWBGH-WGNPLWPVSA-N |
| Mol Weight | 526.8 g/mol |
| Molecular Formula | C33H50O5 |
| Exact Mass | 526.365825 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6cWoMgJCNbV |
|---|---|
| Name | METHYL-3-ACETYL-6-DIDEHYDROSUMARESINOLATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H50O5 |
| InChI | InChI=1S/C33H50O5/c1-20(34)38-25-12-13-30(6)24-11-10-21-22-18-28(2,3)14-16-33(22,27(36)37-9)17-15-31(21,7)32(24,8)19-23(35)26(30)29(25,4)5/h10,22,24-26H,11-19H2,1-9H3/t22?,24?,25-,26?,30+,31+,32+,33-/m0/s1 |
| InChIKey | AXKBLMKSCAWBGH-WGNPLWPVSA-N |
| Literature Reference Author | J.SAKAKIBARA,T.KAIYA,H.FUKUDA |
| Literature Reference Citation | PHYTOCHEM.,23,627(1984) |
| Literature Reference DOI | 10.1016/S0031-9422(00)80395-7 |
| Molecular Weight | 526.757 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBK375 |