![3-O-[.beta.-D-Glucopyranosyl-(1->2).beta.-D-glucuronopyranosyl-methylester]-soyasapogenol-B](/api/spectrum/LJ3tflYzO89/structure.png?h=300&w=458 "3-O-[.beta.-D-Glucopyranosyl-(1->2).beta.-D-glucuronopyranosyl-methylester]-soyasapogenol-B")
| SpectraBase Compound ID | 4QL2QG9PEwr |
|---|---|
| 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?/m1/s1 |
| InChIKey | BMLHAAYMHXIWOH-WQTFDSLLSA-N |
| Mol Weight | 811.0 g/mol |
| Molecular Formula | C43H70O14 |
| Exact Mass | 810.476557 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | LJ3tflYzO89 |
|---|---|
| Name | 3-O-[.beta.-D-Glucopyranosyl-(1->2).beta.-D-glucuronopyranosyl-methylester]-soyasapogenol-B |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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?/m1/s1 |
| InChIKey | BMLHAAYMHXIWOH-WQTFDSLLSA-N |
| Instrument Name | SF = 400 MHz |
| Literature Reference | Chem. Pharm. Bull. 35, 1610 (1987). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | Pyridine-D5 |