| SpectraBase Compound ID | 29y0lWYMwkh |
|---|---|
| InChI | InChI=1S/C31H44N4O5/c1-7-20(4)27(35(5)6)31(39)34-26-28(19(2)3)40-23-15-13-22(14-16-23)25(36)18-32-29(37)24(33-30(26)38)17-21-11-9-8-10-12-21/h8-16,19-20,24-28,36H,7,17-18H2,1-6H3,(H,32,37)(H,33,38)(H,34,39) |
| InChIKey | STKZKAJIJHJDCQ-UHFFFAOYSA-N |
| Mol Weight | 552.7 g/mol |
| Molecular Formula | C31H44N4O5 |
| Exact Mass | 552.331171 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ckg7Dt6ZLk1 |
|---|---|
| Name | Pandamine |
| CAS Registry Number | 10233-81-5 |
| Comments | SOLUTION IN CHCL3/MEOH 2:1 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C31H44N4O5 |
| InChI | InChI=1S/C31H44N4O5/c1-7-20(4)27(35(5)6)31(39)34-26-28(19(2)3)40-23-15-13-22(14-16-23)25(36)18-32-29(37)24(33-30(26)38)17-21-11-9-8-10-12-21/h8-16,19-20,24-28,36H,7,17-18H2,1-6H3,(H,32,37)(H,33,38)(H,34,39) |
| InChIKey | STKZKAJIJHJDCQ-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 |