| SpectraBase Compound ID | 5biyrf7woOk |
|---|---|
| InChI | InChI=1S/C33H42O16/c1-16-25(37)27(39)29(41)32(46-16)49-31-28(40)26(38)23(15-34)47-33(31)48-30-21(43-3)13-18(14-22(30)44-4)6-5-11-45-24(36)10-8-17-7-9-19(35)20(12-17)42-2/h5-10,12-14,16,23,25-29,31-35,37-41H,11,15H2,1-4H3/b6-5+,10-8+/t16-,23+,25-,26+,27+,28-,29+,31+,32-,33-/m0/s1 |
| InChIKey | ZJVODMOTEMJMED-KPCFGSNVSA-N |
| Mol Weight | 694.7 g/mol |
| Molecular Formula | C33H42O16 |
| Exact Mass | 694.247285 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IjK5FkEPKDT |
|---|---|
| Name | SOLARGIN-I;SINAPYL-ALCOHOL-9-O-FERULOYL-4-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H42O16 |
| InChI | InChI=1S/C33H42O16/c1-16-25(37)27(39)29(41)32(46-16)49-31-28(40)26(38)23(15-34)47-33(31)48-30-21(43-3)13-18(14-22(30)44-4)6-5-11-45-24(36)10-8-17-7-9-19(35)20(12-17)42-2/h5-10,12-14,16,23,25-29,31-35,37-41H,11,15H2,1-4H3/b6-5+,10-8+/t16-,23+,25-,26+,27+,28-,29+,31+,32-,33-/m0/s1 |
| InChIKey | ZJVODMOTEMJMED-KPCFGSNVSA-N |
| Literature Reference Author | M.S.KAMEL |
| Literature Reference Citation | PHYTOCHEM.,62,1247(2003) |
| Literature Reference DOI | 10.1016/S0031-9422(03)00022-0 |
| Molecular Weight | 694.687 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU29645 |