| SpectraBase Compound ID | 8kIo5ULDYFq |
|---|---|
| InChI | InChI=1S/C42H66O18/c1-18-35(60-38-33(50)31(48)29(46)26(59-38)17-55-37-32(49)30(47)28(45)25(15-43)58-37)36(53-4)34(51)39(56-18)57-21-7-10-40(2)20(14-21)5-6-24-23(40)8-11-41(3)22(9-12-42(24,41)52)19-13-27(44)54-16-19/h13,18,20-26,28-39,43,45-52H,5-12,14-17H2,1-4H3/t18-,20+,21+,22-,23+,24-,25+,26+,28+,29+,30-,31-,32+,33+,34-,35+,36-,37+,38-,39+,40+,41-,42+/m1/s1 |
| InChIKey | GZVMBXDQUQRICT-FWZNFDCISA-N |
| Mol Weight | 859.0 g/mol |
| Molecular Formula | C42H66O18 |
| Exact Mass | 858.424915 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LW14Zq6chGl |
|---|---|
| Name | UZARIGENIN_BETA-D-GENTIOBIOSYL-(1->4)-BETA-D-DIGINOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H66O18 |
| InChI | InChI=1S/C42H66O18/c1-18-35(60-38-33(50)31(48)29(46)26(59-38)17-55-37-32(49)30(47)28(45)25(15-43)58-37)36(53-4)34(51)39(56-18)57-21-7-10-40(2)20(14-21)5-6-24-23(40)8-11-41(3)22(9-12-42(24,41)52)19-13-27(44)54-16-19/h13,18,20-26,28-39,43,45-52H,5-12,14-17H2,1-4H3/t18-,20+,21+,22-,23+,24-,25+,26+,28+,29+,30-,31-,32+,33+,34-,35+,36-,37+,38-,39+,40+,41-,42+/m1/s1 |
| InChIKey | GZVMBXDQUQRICT-FWZNFDCISA-N |
| Literature Reference Author | R.HANADA,F.ABE,T.YAMAUCHI |
| Literature Reference Citation | PHYTOCHEM.,31,3183(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)83471-A |
| Molecular Weight | 858.975 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ21507 |