| SpectraBase Compound ID | HLzpSTZQtZo |
|---|---|
| InChI | InChI=1S/C34H40O11/c1-9-16(2)28(39)44-27-23(43-17(3)35)25-30(4)12-10-20(36)31(5,29(40)41-8)24(30)22(37)26(38)33(25,7)34-21(45-34)14-19(32(27,34)6)18-11-13-42-15-18/h10-13,15-16,19,21,23,25,27,37H,9,14H2,1-8H3/t16?,19-,21+,23+,25?,27-,30-,31-,32+,33-,34+/m0/s1 |
| InChIKey | WCANMRDCBZNWSJ-HSGMPJLDSA-N |
| Mol Weight | 624.7 g/mol |
| Molecular Formula | C34H40O11 |
| Exact Mass | 624.257062 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1AOc5xvbDlw |
|---|---|
| Name | METHYL-6-HYDROXY-11-BETA-ACETOXY-12-ALPHA-(2-METHYLBUTANOYLOXY)-3,7-DIOXO-14-BETA,15-BETA-EPOXY-1,5-MELIACADIEN-29-OATE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H40O11 |
| InChI | InChI=1S/C34H40O11/c1-9-16(2)28(39)44-27-23(43-17(3)35)25-30(4)12-10-20(36)31(5,29(40)41-8)24(30)22(37)26(38)33(25,7)34-21(45-34)14-19(32(27,34)6)18-11-13-42-15-18/h10-13,15-16,19,21,23,25,27,37H,9,14H2,1-8H3/t16?,19-,21+,23+,25?,27-,30-,31-,32+,33-,34+/m0/s1 |
| InChIKey | WCANMRDCBZNWSJ-HSGMPJLDSA-N |
| Literature Reference Author | M.S.J.SIMMONDS,P.C.STEVENSON,E.A.PORTER,N.C.VEITCH |
| Literature Reference Citation | J.NAT.PROD.,64,1117(2001) |
| Literature Reference DOI | 10.1021/np010197o |
| Molecular Weight | 624.685 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI1850 |