| SpectraBase Compound ID | L2Nk35ZpCXk |
|---|---|
| InChI | InChI=1S/C36H48O20/c1-48-21-7-4-17(11-19(21)39)9-10-50-36-33(56-34-30(46)26(42)20(40)14-52-34)32(55-35-31(47)29(45)27(43)23(13-37)53-35)28(44)24(54-36)15-51-25(41)8-5-16-3-6-18(38)22(12-16)49-2/h3-8,11-12,20,23-24,26-40,42-47H,9-10,13-15H2,1-2H3/b8-5+/t20-,23-,24-,26-,27-,28-,29+,30+,31-,32+,33-,34-,35+,36-/m0/s1 |
| InChIKey | KMDNQBCHLSFQAU-XCWLZFNGSA-N |
| Mol Weight | 800.8 g/mol |
| Molecular Formula | C36H48O20 |
| Exact Mass | 800.273894 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J9YwSuFUv3K |
|---|---|
| Name | KMDNQBCHLSFQAU-XCWLZFNGSA-N |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H48O20 |
| InChI | InChI=1S/C36H48O20/c1-48-21-7-4-17(11-19(21)39)9-10-50-36-33(56-34-30(46)26(42)20(40)14-52-34)32(55-35-31(47)29(45)27(43)23(13-37)53-35)28(44)24(54-36)15-51-25(41)8-5-16-3-6-18(38)22(12-16)49-2/h3-8,11-12,20,23-24,26-40,42-47H,9-10,13-15H2,1-2H3/b8-5+/t20-,23-,24-,26-,27-,28-,29+,30+,31-,32+,33-,34-,35+,36-/m0/s1 |
| InChIKey | KMDNQBCHLSFQAU-XCWLZFNGSA-N |
| Literature Reference Author | H.AOSHIMA,T.MIYASE,A.UENO |
| Literature Reference Citation | PHYTOCHEM.,36,1557(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)89764-2 |
| Molecular Weight | 800.765 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU26488 |