Spektraris NMR
Liriodenine
Common Name: Liriodenine
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H9NO3/c19-16-11-4-2-1-3-10(11)14-13-9(5-6-18-15(13)16)7-12-17(14)21-8-20-12/h1-7H,8H2
InChIKey: InChIKey=MUMCCPUVOAUBAN-UHFFFAOYSA-N
Formula: C17H9N1O3
Molecular Weight: 275.258935
Exact Mass: 275.058243
NMR Solvent: C+M
MHz:
Calibration:
NMR references: 13C - Zhang, Z., ElSohly, H.N., Jacob, M.R., Pasco, D.S., Walker, L.A., Clark, A.M. J Nat Prod (2002) 65, 856-9
Species:
Notes: Family : Alkaloids, Type : Aporphines; 13 C Spectrum from Naproc 13: José Luis López-Pérez, Roberto Therón, Esther del Olmo, David Díaz: NAPROC-13: a database for the dereplication of natural product mixtures in bioassay-guided protocols. Bioinformatics 23(23):3256-3257 (2007)
Carbon NMR Peaks
| Position | PPM |
|---|---|
| 1 (C) | 148.6 |
| 2 (C) | 152.3 |
| 3 (CH) | 103.5 |
| 3a (C) | 145.1 |
| 4 (CH) | 124.9 |
| 5 (CH) | 144.6 |
| 6a (C) | 136.3 |
| 7 (C) | 182.8 |
| 7a (C) | 131.3 |
| 8 (CH) | 128.8 |
| 9 (CH) | 128.9 |
| 10 (CH) | 134.4 |
| 11 (CH) | 127.7 |
| 11a (C) | 133.2 |
| 11b (C) | 108.1 |
| 11c (C) | 123.5 |
| 1a (CH2) | 103 |
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The Spektraris NMR database is developed and hosted by the Lange laboratory at WSU. CAS Registry Number is a Registered Trademark of the American Chemical Society.