| SpectraBase Compound ID | CerU2RCdvxa |
|---|---|
| InChI | InChI=1S/C37H50N6O6/c1-9-22(4)31(43(7)8)35(47)41-30(21(2)3)34(46)42-32-36(48)40-28(18-24-19-38-27-13-11-10-12-26(24)27)33(45)39-20-29(44)23-14-16-25(17-15-23)49-37(32,5)6/h10-17,19,21-22,28,30-32,38H,9,18,20H2,1-8H3,(H,39,45)(H,40,48)(H,41,47)(H,42,46) |
| InChIKey | ATQXXRJEZULCTG-UHFFFAOYSA-N |
| Mol Weight | 674.8 g/mol |
| Molecular Formula | C37H50N6O6 |
| Exact Mass | 674.379183 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ArDMrViiHJE |
|---|---|
| Name | Hymenocardine |
| CAS Registry Number | 19771-56-3 |
| Comments | SOLUTION IN CHCL3/MEOH 2:1 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C37H50N6O6 |
| InChI | InChI=1S/C37H50N6O6/c1-9-22(4)31(43(7)8)35(47)41-30(21(2)3)34(46)42-32-36(48)40-28(18-24-19-38-27-13-11-10-12-26(24)27)33(45)39-20-29(44)23-14-16-25(17-15-23)49-37(32,5)6/h10-17,19,21-22,28,30-32,38H,9,18,20H2,1-8H3,(H,39,45)(H,40,48)(H,41,47)(H,42,46) |
| InChIKey | ATQXXRJEZULCTG-UHFFFAOYSA-N |
| Instrument Name | Varian DP-60 |
| Literature Reference | M. Pais, F. Jarreau, Phytochem. 18, 1869 (1979). |
| NMR Standard | CHCl3 |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CHCl3 |