| SpectraBase Compound ID | 8IlsiAYHpm3 |
|---|---|
| InChI | InChI=1S/C30H40O13/c1-15(2)9-24(35)43-29-25-19(17(13-39-29)14-40-30-28(38)27(37)26(36)22(12-32)42-30)10-21(20(25)11-31)41-18-6-3-16(4-7-18)5-8-23(33)34/h3-8,13,15,19-22,25-32,36-38H,9-12,14H2,1-2H3,(H,33,34)/b8-5+/t19?,20-,21-,22-,25?,26-,27+,28-,29-,30-/m0/s1 |
| InChIKey | MYHQAXKQYFKPAZ-HJFWHAJLSA-N |
| Mol Weight | 608.6 g/mol |
| Molecular Formula | C30H40O13 |
| Exact Mass | 608.246891 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8VBdyDr8fhj |
|---|---|
| Name | 7-PARA-COUMARYLPATRINOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H40O13 |
| InChI | InChI=1S/C30H40O13/c1-15(2)9-24(35)43-29-25-19(17(13-39-29)14-40-30-28(38)27(37)26(36)22(12-32)42-30)10-21(20(25)11-31)41-18-6-3-16(4-7-18)5-8-23(33)34/h3-8,13,15,19-22,25-32,36-38H,9-12,14H2,1-2H3,(H,33,34)/b8-5+/t19?,20-,21-,22-,25?,26-,27+,28-,29-,30-/m0/s1 |
| InChIKey | MYHQAXKQYFKPAZ-HJFWHAJLSA-N |
| Literature Reference Author | L.TOMASSINI,D.BRKIC,S.FODDAI,M.NICOLETTI |
| Literature Reference Citation | PHYTOCHEM.,44,751(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(96)00600-0 |
| Molecular Weight | 608.640 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWPA292 |