| SpectraBase Compound ID | CDpkeicB06V |
|---|---|
| InChI | InChI=1S/C31H40O17/c1-12-20(36)23(39)26(45-18(35)6-4-13-3-5-15(34)16(9-13)41-2)30(43-12)46-25-14-7-8-42-28(19(14)31(11-33)27(25)48-31)47-29-24(40)22(38)21(37)17(10-32)44-29/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 | OKDURJFCTBLRIG-JFKITHKRSA-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 | EkyqCvHHgMQ |
|---|---|
| Name | 6-O-ALPHA-L-(2''-O-FERULOYL)-RHAMNOPYRANOSYL-CATALPOL |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H40O17 |
| InChI | InChI=1S/C31H40O17/c1-12-20(36)23(39)26(45-18(35)6-4-13-3-5-15(34)16(9-13)41-2)30(43-12)46-25-14-7-8-42-28(19(14)31(11-33)27(25)48-31)47-29-24(40)22(38)21(37)17(10-32)44-29/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 | OKDURJFCTBLRIG-JFKITHKRSA-N |
| Literature Reference Author | H.OTSUKA,N.KUBO,Y.SASAKI,K.YAMASAKI,Y.TAKEDA,T.SEKI |
| Literature Reference Citation | PHYTOCHEM.,30,1917(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)85040-7 |
| Molecular Weight | 684.648 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU28101 |