| SpectraBase Compound ID | B7wmsZNzsDU |
|---|---|
| InChI | InChI=1S/C32H50O4/c1-20(2)22-12-17-32(28(34)36-9)19-18-30(6)24(27(22)32)10-11-25-29(5,15-14-26(33)35-8)23(21(3)4)13-16-31(25,30)7/h22-25,27H,1,3,10-19H2,2,4-9H3/t22-,23-,24+,25+,27+,29-,30+,31+,32-/m0/s1 |
| InChIKey | YNRWXJMYFNSSJG-KQPKBLAKSA-N |
| Mol Weight | 498.7 g/mol |
| Molecular Formula | C32H50O4 |
| Exact Mass | 498.37091 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GbsshnCVbZB |
|---|---|
| Name | 3,4-SECO-LUPA-4(23),20(29)-DIEN-3,28-DICARBOXYLIC-ACID-DIMETHYLESTER |
| Compound Number | 18 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H50O4 |
| InChI | InChI=1S/C32H50O4/c1-20(2)22-12-17-32(28(34)36-9)19-18-30(6)24(27(22)32)10-11-25-29(5,15-14-26(33)35-8)23(21(3)4)13-16-31(25,30)7/h22-25,27H,1,3,10-19H2,2,4-9H3/t22-,23-,24+,25+,27+,29-,30+,31+,32-/m0/s1 |
| InChIKey | YNRWXJMYFNSSJG-KQPKBLAKSA-N |
| Literature Reference Author | B.BLAES,J.ZAPP,H.BECKER |
| Literature Reference Citation | PHYTOCHEM.,65,127(2004) |
| Literature Reference DOI | 10.1016/S0031-9422(03)00387-X |
| Molecular Weight | 498.747 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU34577 |