| SpectraBase Compound ID | KXdIemYstTf |
|---|---|
| InChI | InChI=1S/C27H26O18/c28-9-2-1-7(3-10(9)29)13-6-12(31)15-11(30)4-8(5-14(15)42-13)41-27-23(19(35)18(34)22(44-27)25(39)40)45-26-20(36)16(32)17(33)21(43-26)24(37)38/h1-6,16-23,26-30,32-36H,(H,37,38)(H,39,40)/t16-,17-,18-,19-,20+,21-,22-,23+,26-,27+/m1/s1 |
| InChIKey | PBBVWJQPAZYQDB-NSHQGHFVSA-N |
| Mol Weight | 638.49 g/mol |
| Molecular Formula | C27H26O18 |
| Exact Mass | 638.111914 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8rVjSjoR9yJ |
|---|---|
| Name | SCUTELLAREIN-BETA-D-7-O-GLUCURONOSYL-BETA-D-(1->2)-BETA-D-GLUCURONIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H26O18 |
| InChI | InChI=1S/C27H26O18/c28-9-2-1-7(3-10(9)29)13-6-12(31)15-11(30)4-8(5-14(15)42-13)41-27-23(19(35)18(34)22(44-27)25(39)40)45-26-20(36)16(32)17(33)21(43-26)24(37)38/h1-6,16-23,26-30,32-36H,(H,37,38)(H,39,40)/t16-,17-,18-,19-,20+,21-,22-,23+,26-,27+/m1/s1 |
| InChIKey | PBBVWJQPAZYQDB-NSHQGHFVSA-N |
| Literature Reference Author | K.YOSHIDA,K.KAMEDA,T.KONDO |
| Literature Reference Citation | PHYTOCHEM.,33,917(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)85304-A |
| Molecular Weight | 638.493 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWKP6236 |