| SpectraBase Compound ID | 5zUSAErYtJk |
|---|---|
| InChI | InChI=1S/C31H40O16/c1-41-19-7-4-16(11-18(19)34)9-10-43-30-28(40)29(47-31-27(39)26(38)24(36)21(13-32)45-31)25(37)22(46-30)14-44-23(35)8-5-15-3-6-17(33)20(12-15)42-2/h3-8,11-12,21-22,24-34,36-40H,9-10,13-14H2,1-2H3/b8-5+/t21-,22+,24-,25+,26+,27-,28+,29-,30+,31+/m1/s1 |
| InChIKey | MTKGYCQUEWGDQW-LFPGJLKESA-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 | EZdt166XvkX |
|---|---|
| Name | SCROSIDE-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H40O16 |
| InChI | InChI=1S/C31H40O16/c1-41-19-7-4-16(11-18(19)34)9-10-43-30-28(40)29(47-31-27(39)26(38)24(36)21(13-32)45-31)25(37)22(46-30)14-44-23(35)8-5-15-3-6-17(33)20(12-15)42-2/h3-8,11-12,21-22,24-34,36-40H,9-10,13-14H2,1-2H3/b8-5+/t21-,22+,24-,25+,26+,27-,28+,29-,30+,31+/m1/s1 |
| InChIKey | MTKGYCQUEWGDQW-LFPGJLKESA-N |
| Literature Reference Author | J.X.LI,P.LI,Y.TEZUKA,T.NAMBA,S.KADOTA |
| Literature Reference Citation | PHYTOCHEM.,48,537(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00030-2 |
| Molecular Weight | 668.649 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS1077 |