| SpectraBase Compound ID | DljxlS9bADJ |
|---|---|
| InChI | InChI=1S/C35H42N2O9/c1-40-21-8-9-22-23-11-12-37-18-20-15-29(46-30(38)10-7-19-13-27(41-2)33(43-4)28(14-19)42-3)34(44-5)31(35(39)45-6)24(20)17-26(37)32(23)36-25(22)16-21/h7-10,13-14,16,20,24,26,29,31,34,36H,11-12,15,17-18H2,1-6H3/b10-7+/t20-,24+,26-,29-,31+,34+/m1/s1 |
| InChIKey | SZLZWPPUNLXJEA-QEGASFHISA-N |
| Mol Weight | 634.7 g/mol |
| Molecular Formula | C35H42N2O9 |
| Exact Mass | 634.289031 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JEquuhIT5HU |
|---|---|
| Name | 11,17alpha-dimethoxy-18 beta-hydroxy-3 beta,20alpha-yohimban-16 beta-carboxylic acid, methyl ester, 3,4,5-trimethoxycinnamate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C35H42N2O9 |
| InChI | InChI=1S/C35H42N2O9/c1-40-21-8-9-22-23-11-12-37-18-20-15-29(46-30(38)10-7-19-13-27(41-2)33(43-4)28(14-19)42-3)34(44-5)31(35(39)45-6)24(20)17-26(37)32(23)36-25(22)16-21/h7-10,13-14,16,20,24,26,29,31,34,36H,11-12,15,17-18H2,1-6H3/b10-7+/t20-,24+,26-,29-,31+,34+/m1/s1 |
| InChIKey | SZLZWPPUNLXJEA-QEGASFHISA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 34273M |
| Solvent | CDCl3 |