| SpectraBase Compound ID | A1vsMHkAL5b |
|---|---|
| InChI | InChI=1S/C31H38O16/c1-14-27(44-15(2)33)24(39)25(40)31(43-14)47-29-26(41)30(42-10-9-17-4-7-19(35)21(37)12-17)45-22(13-32)28(29)46-23(38)8-5-16-3-6-18(34)20(36)11-16/h3-8,11-12,14,22,24-32,34-37,39-41H,9-10,13H2,1-2H3/b8-5+/t14-,22-,24-,25+,26-,27-,28-,29-,30-,31-/m0/s1 |
| InChIKey | JCUVYORJFAOCLA-SVPRKOBPSA-N |
| Mol Weight | 666.6 g/mol |
| Molecular Formula | C31H38O16 |
| Exact Mass | 666.215985 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E4btAOM9PRI |
|---|---|
| Name | 4'''-O-ACETYLVERBASCOSIDE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H38O16 |
| InChI | InChI=1S/C31H38O16/c1-14-27(44-15(2)33)24(39)25(40)31(43-14)47-29-26(41)30(42-10-9-17-4-7-19(35)21(37)12-17)45-22(13-32)28(29)46-23(38)8-5-16-3-6-18(34)20(36)11-16/h3-8,11-12,14,22,24-32,34-37,39-41H,9-10,13H2,1-2H3/b8-5+/t14-,22-,24-,25+,26-,27-,28-,29-,30-,31-/m0/s1 |
| InChIKey | JCUVYORJFAOCLA-SVPRKOBPSA-N |
| Literature Reference Author | T.KANCHANAPOOM,R.KASAI,K.YAMASAKI |
| Literature Reference Citation | PHYTOCHEM.,59,565(2002) |
| Literature Reference DOI | 10.1016/S0031-9422(01)00476-9 |
| Molecular Weight | 666.633 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN2745 |