| SpectraBase Compound ID | BAEAG2B16gF |
|---|---|
| InChI | InChI=1S/C35H42O16/c1-15-10-21(46-3)26(32-25(15)20(40)12-19(47-32)11-16(2)38)33-34(50-24(41)9-6-17-4-7-18(39)8-5-17)30(45)31(23(14-37)48-33)51-35-29(44)28(43)27(42)22(13-36)49-35/h4-10,12,16,22-23,27-31,33-39,42-45H,11,13-14H2,1-3H3/b9-6+/t16-,22-,23+,27-,28+,29-,30-,31+,33-,34+,35+/m0/s1 |
| InChIKey | JMWQNLUKXOSZLJ-WOMYMDRNSA-N |
| Mol Weight | 718.7 g/mol |
| Molecular Formula | C35H42O16 |
| Exact Mass | 718.247285 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HDhb7kNk7XO |
|---|---|
| Name | 4'-O-GLUCOSYL-ISOALOERESIN-DI |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H42O16 |
| InChI | InChI=1S/C35H42O16/c1-15-10-21(46-3)26(32-25(15)20(40)12-19(47-32)11-16(2)38)33-34(50-24(41)9-6-17-4-7-18(39)8-5-17)30(45)31(23(14-37)48-33)51-35-29(44)28(43)27(42)22(13-36)49-35/h4-10,12,16,22-23,27-31,33-39,42-45H,11,13-14H2,1-3H3/b9-6+/t16-,22-,23+,27-,28+,29-,30-,31+,33-,34+,35+/m0/s1 |
| InChIKey | JMWQNLUKXOSZLJ-WOMYMDRNSA-N |
| Literature Reference Author | N.OKAMURA,N.HINE,Y.TATEYAMA,M.NAKAZAWA,T.FUJIOKA,K.MIHASHI,A .YAGI |
| Literature Reference Citation | PHYTOCHEM.,49,219(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)01071-6 |
| Molecular Weight | 718.709 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU88 |