| SpectraBase Compound ID | BuGKKFmEcaR |
|---|---|
| InChI | InChI=1S/C40H68O15/c1-18(17-51-36-34(48)32(46)30(44)26(15-41)53-36)8-11-40(50-5)19(2)29-25(55-40)14-24-22-7-6-20-12-21(52-37-35(49)33(47)31(45)27(16-42)54-37)13-28(43)39(20,4)23(22)9-10-38(24,29)3/h18-37,41-49H,6-17H2,1-5H3/t18?,19-,20-,21-,22?,23?,24?,25?,26-,27+,28+,29?,30-,31+,32+,33-,34-,35+,36-,37+,38-,39-,40?/m0/s1 |
| InChIKey | VQYYIEDNADDNKN-PJBFVBATSA-N |
| Mol Weight | 789.0 g/mol |
| Molecular Formula | C40H68O15 |
| Exact Mass | 788.455821 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5zaTnGKgmru |
|---|---|
| Name | 26-O-BETA-D-GLUCOPYRANOSYL-22-O-METHYL-(25S)-5-ALPHA-FUROSTANE-1-BETA,3-ALPHA,22-XI,26-TETROL-3-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H68O15 |
| InChI | InChI=1S/C40H68O15/c1-18(17-51-36-34(48)32(46)30(44)26(15-41)53-36)8-11-40(50-5)19(2)29-25(55-40)14-24-22-7-6-20-12-21(52-37-35(49)33(47)31(45)27(16-42)54-37)13-28(43)39(20,4)23(22)9-10-38(24,29)3/h18-37,41-49H,6-17H2,1-5H3/t18?,19-,20-,21-,22?,23?,24?,25?,26-,27+,28+,29?,30-,31+,32+,33-,34-,35+,36-,37+,38-,39-,40?/m0/s1 |
| InChIKey | VQYYIEDNADDNKN-PJBFVBATSA-N |
| Literature Reference Author | Y.MIMAKI,Y.TAKAASHI,M.KURODA,Y.SASHIDA |
| Literature Reference Citation | PHYTOCHEM.,45,1229(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00109-X |
| Molecular Weight | 788.971 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWSP519 |