| SpectraBase Compound ID | 1Fn1y0wGPYA |
|---|---|
| InChI | InChI=1S/C31H40O17/c1-12-25(45-18(35)6-4-13-3-5-15(34)16(9-13)41-2)22(38)24(40)29(43-12)46-26-14-7-8-42-28(19(14)31(11-33)27(26)48-31)47-30-23(39)21(37)20(36)17(10-32)44-30/h3-9,12,14,17,19-30,32-34,36-40H,10-11H2,1-2H3/b6-4+/t12-,14-,17-,19-,20-,21+,22-,23-,24+,25-,26+,27+,28+,29-,30+,31-/m1/s1 |
| InChIKey | VHEDPUBPGAYIFA-BLGIXMKMSA-N |
| Mol Weight | 684.6 g/mol |
| Molecular Formula | C31H40O17 |
| Exact Mass | 684.22655 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 18cCfGqvtu7 |
|---|---|
| Name | SCROPOLIOSIDE-G;6-O-ALPHA-L-(4''-O-FERULOYL)-RHAMNOPYRANOSYL-CATALPOL |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H40O17 |
| InChI | InChI=1S/C31H40O17/c1-12-25(45-18(35)6-4-13-3-5-15(34)16(9-13)41-2)22(38)24(40)29(43-12)46-26-14-7-8-42-28(19(14)31(11-33)27(26)48-31)47-30-23(39)21(37)20(36)17(10-32)44-30/h3-9,12,14,17,19-30,32-34,36-40H,10-11H2,1-2H3/b6-4+/t12-,14-,17-,19-,20-,21+,22-,23-,24+,25-,26+,27+,28+,29-,30+,31-/m1/s1 |
| InChIKey | VHEDPUBPGAYIFA-BLGIXMKMSA-N |
| Literature Reference Author | T.ZHU,L.ZHANG,S.LING,F.QIAN,Y.LI,J.W.XU |
| Literature Reference Citation | MOLECULES,20,19823(2015) |
| Literature Reference DOI | 10.3390/molecules201119659 |
| Molecular Weight | 684.648 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWPA6035 |