| SpectraBase Compound ID | Eq4GJO1L4pD |
|---|---|
| InChI | InChI=1S/C36H44O11/c1-9-27(40)46-29-20(4)17-36(47-23(7)39)28(29)31(43-21(5)37)35-18-42-34(8,33(36)44-22(6)38)30(35)25(19(2)3)15-16-26(35)45-32(41)24-13-11-10-12-14-24/h10-16,20,25-26,28-31,33H,2,9,17-18H2,1,3-8H3/t20-,25+,26+,28+,29-,30-,31+,33-,34+,35+,36+/m0/s1 |
| InChIKey | HUVLAOORYMIHTC-WDBLXRTOSA-N |
| Mol Weight | 652.7 g/mol |
| Molecular Formula | C36H44O11 |
| Exact Mass | 652.288362 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EMCPEVcJgrO |
|---|---|
| Name | 14-DESOXO-3-O-PROPIONYL-5,15-DI-O-ACETYL-7-O-BENZOYL-MYRSINOL-14-BETA-ACETATE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H44O11 |
| InChI | InChI=1S/C36H44O11/c1-9-27(40)46-29-20(4)17-36(47-23(7)39)28(29)31(43-21(5)37)35-18-42-34(8,33(36)44-22(6)38)30(35)25(19(2)3)15-16-26(35)45-32(41)24-13-11-10-12-14-24/h10-16,20,25-26,28-31,33H,2,9,17-18H2,1,3-8H3/t20-,25+,26+,28+,29-,30-,31+,33-,34+,35+,36+/m0/s1 |
| InChIKey | HUVLAOORYMIHTC-WDBLXRTOSA-N |
| Literature Reference Author | F.JESKE,J.JAKUPOVIC,W.BERENDSOHN |
| Literature Reference Citation | PHYTOCHEM.,40,1743(1995) |
| Literature Reference DOI | 10.1016/0031-9422(95)00514-8 |
| Molecular Weight | 652.739 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU4564 |