| SpectraBase Compound ID | 25C2bywTyxU |
|---|---|
| InChI | InChI=1S/C43H56O9/c1-25-15-20-42(38(48)49)21-22-43(24-50-36(47)14-10-29-9-12-31(51-27(3)44)32(23-29)52-28(4)45)30(37(42)26(25)2)11-13-34-40(7)18-17-35(46)39(5,6)33(40)16-19-41(34,43)8/h9-12,14,23,25-26,33-34,37H,13,15-22,24H2,1-8H3,(H,48,49)/b14-10+/t25-,26+,33-,34+,37-,40-,41+,42-,43-/m0/s1 |
| InChIKey | LMHNOLXJKDMLJC-BZZQSEFQSA-N |
| Mol Weight | 716.9 g/mol |
| Molecular Formula | C43H56O9 |
| Exact Mass | 716.392433 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B6dbznLIsDG |
|---|---|
| Name | MYRICERIC-ACID-D-DIACETATE |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H56O9 |
| InChI | InChI=1S/C43H56O9/c1-25-15-20-42(38(48)49)21-22-43(24-50-36(47)14-10-29-9-12-31(51-27(3)44)32(23-29)52-28(4)45)30(37(42)26(25)2)11-13-34-40(7)18-17-35(46)39(5,6)33(40)16-19-41(34,43)8/h9-12,14,23,25-26,33-34,37H,13,15-22,24H2,1-8H3,(H,48,49)/b14-10+/t25-,26+,33-,34+,37-,40-,41+,42-,43-/m0/s1 |
| InChIKey | LMHNOLXJKDMLJC-BZZQSEFQSA-N |
| Literature Reference Author | K.SAKURAWI,F.YASUDA,T.TOZYO,M.NAKAMURA,T.SATO,J.KIKUCHI,Y.TE RUI,Y.IKENISHI,T.IW |
| Literature Reference Citation | CHEM.PHARM.BULL.,44,343(1996) |
| Literature Reference DOI | 10.1248/cpb.44.343 |
| Molecular Weight | 716.912 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU31659 |