Spektraris NMR
Homofascaplysin A
Common Name: Homofascaplysin A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C21H16N2O2/c1-13(24)12-21(25)16-7-3-5-9-18(16)23-11-10-15-14-6-2-4-8-17(14)22-19(15)20(21)23/h2-11,25H,12H2,1H3/p+1
InChIKey: InChIKey=FMBFXCZLVADMCC-UHFFFAOYSA-O
Formula: C21H16N2O2
Molecular Weight: 328.364802
Exact Mass: 328.121178
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Kirsch, G., Kong, G.M., Wright, A.D., Kaminsky, R. J Nat Prod (2000) 63, 825-9
Species:
Notes: Family : Alkaloids, Type : Canthinones; 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 (CH) | 119.3 |
| 2 (CH) | 125.6 |
| 4 (C) | 143.5 |
| 5 (C) | 139.6 |
| 6 (C) | 80.1 |
| 8 (CH) | 115 |
| 9 (CH) | 135 |
| 10 (CH) | 124.6 |
| 11 (CH) | 125.3 |
| 12 (C) | 122.3 |
| 13 (C) | 147.7 |
| 14 (C) | 137.6 |
| 15 (C) | 122.3 |
| 16 (C) | 145.8 |
| 1' (CH) | 116.1 |
| 2' (CH) | 133.1 |
| 3' (CH) | 132.8 |
| 4' (CH) | 126.7 |
| 6a (CH2) | 52.4 |
| 6b (C) | 207.4 |
| 6c (CH3) | 31 |
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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.