| SpectraBase Compound ID | ABvnNtFH3pt |
|---|---|
| InChI | InChI=1S/C26H32O13/c1-11-17(30)8-15-16(24(33)34-3)10-35-25(19(11)15)39-26-22(38-23(32)13-5-4-6-14(29)7-13)20(31)21(36-12(2)28)18(9-27)37-26/h4-7,10-11,15,17-22,25-27,29-31H,8-9H2,1-3H3/t11-,15+,17-,18+,19+,20-,21+,22+,25-,26-/m0/s1 |
| InChIKey | LXDIJQSXQCZMRW-NJPZLMRLSA-N |
| Mol Weight | 552.5 g/mol |
| Molecular Formula | C26H32O13 |
| Exact Mass | 552.184291 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 73UZt4LkZhS |
|---|---|
| Name | 4'-ACETYL-2'-META-HYDROXYBENZOYL-LOGANIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H32O13 |
| InChI | InChI=1S/C26H32O13/c1-11-17(30)8-15-16(24(33)34-3)10-35-25(19(11)15)39-26-22(38-23(32)13-5-4-6-14(29)7-13)20(31)21(36-12(2)28)18(9-27)37-26/h4-7,10-11,15,17-22,25-27,29-31H,8-9H2,1-3H3/t11-,15+,17-,18+,19+,20-,21+,22+,25-,26-/m0/s1 |
| InChIKey | LXDIJQSXQCZMRW-NJPZLMRLSA-N |
| Literature Reference Author | E.M.MPONDO,J.GARCIA |
| Literature Reference Citation | PHYTOCHEM.,29,643(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)85134-2 |
| Molecular Weight | 552.532 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN29353 |