![3-O-BETA-[6-O-METHYL-GLUCURONOPYRANOSYL]-ECHINOCYSTIC-ACID](/api/spectrum/BAwxuldt4XR/structure.png?h=300&w=458 "3-O-BETA-[6-O-METHYL-GLUCURONOPYRANOSYL]-ECHINOCYSTIC-ACID")
| SpectraBase Compound ID | FnQwpVDmEU6 |
|---|---|
| InChI | InChI=1S/C37H58O10/c1-32(2)15-16-37(31(43)44)20(17-32)19-9-10-22-34(5)13-12-24(46-30-27(41)25(39)26(40)28(47-30)29(42)45-8)33(3,4)21(34)11-14-35(22,6)36(19,7)18-23(37)38/h9,20-28,30,38-41H,10-18H2,1-8H3,(H,43,44)/t20?,21?,22?,23-,24+,25+,26+,27-,28+,30-,34+,35-,36-,37-/m1/s1 |
| InChIKey | UKUKDKRGVVIVIE-BSHMMWLWSA-N |
| Mol Weight | 662.9 g/mol |
| Molecular Formula | C37H58O10 |
| Exact Mass | 662.402998 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BAwxuldt4XR |
|---|---|
| Name | 3-O-BETA-[6-O-METHYL-GLUCURONOPYRANOSYL]-ECHINOCYSTIC-ACID |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H58O10 |
| InChI | InChI=1S/C37H58O10/c1-32(2)15-16-37(31(43)44)20(17-32)19-9-10-22-34(5)13-12-24(46-30-27(41)25(39)26(40)28(47-30)29(42)45-8)33(3,4)21(34)11-14-35(22,6)36(19,7)18-23(37)38/h9,20-28,30,38-41H,10-18H2,1-8H3,(H,43,44)/t20?,21?,22?,23-,24+,25+,26+,27-,28+,30-,34+,35-,36-,37-/m1/s1 |
| InChIKey | UKUKDKRGVVIVIE-BSHMMWLWSA-N |
| Literature Reference Author | N.TAN,J.ZHOU,S.ZHAO |
| Literature Reference Citation | PHYTOCHEM.,52,153(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00454-3 |
| Molecular Weight | 662.862 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN1008 |