![3-O-[.beta.-D-Glucopyranosyl-(1->2).beta.-D-glucuronopyranosyl-methylester]-soyasapogenol-B](/api/spectrum/CV9OzKhKHcv/structure.png?h=300&w=458 "3-O-[.beta.-D-Glucopyranosyl-(1->2).beta.-D-glucuronopyranosyl-methylester]-soyasapogenol-B")
| SpectraBase Compound ID | 38JgC9IFfWg |
|---|---|
| InChI | InChI=1S/C43H70O14/c1-38(2)17-22-21-9-10-25-40(4)13-12-27(41(5,20-45)24(40)11-14-43(25,7)42(21,6)16-15-39(22,3)26(46)18-38)55-37-34(31(50)30(49)33(56-37)35(52)53-8)57-36-32(51)29(48)28(47)23(19-44)54-36/h9,22-34,36-37,44-51H,10-20H2,1-8H3/t22-,23+,24?,25?,26+,27-,28+,29-,30-,31-,32+,33-,34+,36-,37+,39+,40-,41+,42+,43+/m0/s1 |
| InChIKey | BMLHAAYMHXIWOH-KZHFQSKHSA-N |
| Mol Weight | 811.0 g/mol |
| Molecular Formula | C43H70O14 |
| Exact Mass | 810.476557 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CV9OzKhKHcv |
|---|---|
| Name | 3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL-METHYLESTER]-SOYASAPOGENOL-B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H70O14 |
| InChI | InChI=1S/C43H70O14/c1-38(2)17-22-21-9-10-25-40(4)13-12-27(41(5,20-45)24(40)11-14-43(25,7)42(21,6)16-15-39(22,3)26(46)18-38)55-37-34(31(50)30(49)33(56-37)35(52)53-8)57-36-32(51)29(48)28(47)23(19-44)54-36/h9,22-34,36-37,44-51H,10-20H2,1-8H3/t22-,23+,24?,25?,26+,27-,28+,29-,30-,31-,32+,33-,34+,36-,37+,39+,40-,41+,42+,43+/m0/s1 |
| InChIKey | BMLHAAYMHXIWOH-KZHFQSKHSA-N |
| Literature Reference Author | T.FUKUNAGA,K.NISHIYA,K.TAKEYA,H.ITOKAWA |
| Literature Reference Citation | CHEM.PHARM.BULL.,35,1610(1987) |
| Literature Reference DOI | 10.1248/cpb.35.1610 |
| Molecular Weight | 811.020 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBK238 |