![UNDULOSIDE;6-O-[(2''-O-TRANS-FERULOYL)-ALPHA-L-RHANMOPYRANOSYL]-AUCUBIN](/api/spectrum/2zE4MqXXLQ9/structure.png?h=300&w=458 "UNDULOSIDE;6-O-[(2''-O-TRANS-FERULOYL)-ALPHA-L-RHANMOPYRANOSYL]-AUCUBIN")
| SpectraBase Compound ID | LgpdI7rB0m5 |
|---|---|
| InChI | InChI=1S/C31H40O16/c1-13-23(36)26(39)28(46-21(35)6-4-14-3-5-17(34)19(9-14)41-2)31(43-13)44-18-10-15(11-32)22-16(18)7-8-42-29(22)47-30-27(40)25(38)24(37)20(12-33)45-30/h3-10,13,16,18,20,22-34,36-40H,11-12H2,1-2H3/b6-4+/t13-,16-,18+,20+,22+,23-,24+,25-,26+,27+,28+,29-,30-,31-/m0/s1 |
| InChIKey | JKLCTVDYVIZSMA-CXLKIWCRSA-N |
| Mol Weight | 668.6 g/mol |
| Molecular Formula | C31H40O16 |
| Exact Mass | 668.231635 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2zE4MqXXLQ9 |
|---|---|
| Name | UNDULOSIDE;6-O-[(2''-O-TRANS-FERULOYL)-ALPHA-L-RHANMOPYRANOSYL]-AUCUBIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H40O16 |
| InChI | InChI=1S/C31H40O16/c1-13-23(36)26(39)28(46-21(35)6-4-14-3-5-17(34)19(9-14)41-2)31(43-13)44-18-10-15(11-32)22-16(18)7-8-42-29(22)47-30-27(40)25(38)24(37)20(12-33)45-30/h3-10,13,16,18,20,22-34,36-40H,11-12H2,1-2H3/b6-4+/t13-,16-,18+,20+,22+,23-,24+,25-,26+,27+,28+,29-,30-,31-/m0/s1 |
| InChIKey | JKLCTVDYVIZSMA-CXLKIWCRSA-N |
| Literature Reference Author | A.L.SKALTSOUNIS,E.TSITSA-TZARDIS,C.DEMETZOS,C.HARVALA |
| Literature Reference Citation | J.NAT.PROD.,59,673(1996) |
| Literature Reference DOI | 10.1021/np960181b |
| Molecular Weight | 668.649 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCS15386 |