| SpectraBase Compound ID | 8WJR59YxQxz |
|---|---|
| InChI | InChI=1S/C37H58O13/c1-32(2)11-13-36(30(46)50-29-26(43)25(42)24(41)20(16-38)49-29)14-12-34(4)18(23(36)28(32)45)7-8-21-33(3)15-19(40)27(44)37(17-39,31(47)48-6)22(33)9-10-35(21,34)5/h7,19-29,38-45H,8-17H2,1-6H3/t19?,20?,21-,22?,23+,24?,25?,26?,27?,28+,29?,33?,34-,35-,36-,37?/m1/s1 |
| InChIKey | CLYSOORYRXYAFR-SENBPAAYSA-N |
| Mol Weight | 710.9 g/mol |
| Molecular Formula | C37H58O13 |
| Exact Mass | 710.387742 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bda8D3Jc4aH |
|---|---|
| Name | Trachelosperoside-D-1,methylester |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C37H58O13 |
| InChI | InChI=1S/C37H58O13/c1-32(2)11-13-36(30(46)50-29-26(43)25(42)24(41)20(16-38)49-29)14-12-34(4)18(23(36)28(32)45)7-8-21-33(3)15-19(40)27(44)37(17-39,31(47)48-6)22(33)9-10-35(21,34)5/h7,19-29,38-45H,8-17H2,1-6H3/t19?,20?,21-,22?,23+,24?,25?,26?,27?,28+,29?,33?,34-,35-,36-,37?/m1/s1 |
| InChIKey | CLYSOORYRXYAFR-SENBPAAYSA-N |
| Literature Reference | Chem. Pharm. Bull. 35, 1833 (1987). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | Pyridine-D5 |