| SpectraBase Compound ID | GulRZAQwFZo |
|---|---|
| InChI | InChI=1S/C22H32O13/c1-5-9(2)19(29)33-10(3)15-11(6-14(24)25)12(20(30)31-4)8-32-21(15)35-22-18(28)17(27)16(26)13(7-23)34-22/h5,8,10-11,13,15-18,21-23,26-28H,6-7H2,1-4H3,(H,24,25)/b9-5+/t10?,11-,13+,15-,16+,17-,18+,21?,22-/m0/s1 |
| InChIKey | JVEXRQAKPOSWCW-FACQWYHOSA-N |
| Mol Weight | 504.5 g/mol |
| Molecular Formula | C22H32O13 |
| Exact Mass | 504.184291 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4pSGNk0XTiv |
|---|---|
| Name | 8-O-TIGLOYLDIDERROSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H32O13 |
| InChI | InChI=1S/C22H32O13/c1-5-9(2)19(29)33-10(3)15-11(6-14(24)25)12(20(30)31-4)8-32-21(15)35-22-18(28)17(27)16(26)13(7-23)34-22/h5,8,10-11,13,15-18,21-23,26-28H,6-7H2,1-4H3,(H,24,25)/b9-5+/t10?,11-,13+,15-,16+,17-,18+,21?,22-/m0/s1 |
| InChIKey | JVEXRQAKPOSWCW-FACQWYHOSA-N |
| Literature Reference Author | L.M.C.ZULETA,A.J.CAVALHEIRO,D.H.S.SILVA,M.FURLAN,M.C.M.YOUNG ,S.ALBUQUERQUE,I.CAS |
| Literature Reference Citation | PHYTOCHEM.,64,549(2003) |
| Literature Reference DOI | 10.1016/S0031-9422(03)00153-5 |
| Molecular Weight | 504.488 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWKP850 |