Spektraris NMR
Interruptin D
Common Name: Interruptin D
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C25H18O6/c1-14-21(27)19-17(16-10-6-3-7-11-16)12-18(26)30-23(19)20-22(14)31-25(29,24(20)28)13-15-8-4-2-5-9-15/h2-12,27,29H,13H2,1H3
InChIKey: InChIKey=YICIIZDXYKQWHP-UHFFFAOYSA-N
Formula: C25H18O6
Molecular Weight: 414.407761
Exact Mass: 414.110338
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Quadri-Spinelli T., Heilman J., Rali T., Sticher O. Planta Med (2000) 66, 728
Species:
Notes: Family : Flavonoids, Type : Neoflavonoids; 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 |
|---|---|
| 2 (C) | 159.5 |
| 3 (CH) | 112.5 |
| 4 (C) | 154.1 |
| 5 (C) | 157 |
| 6 (C) | 107 |
| 7 (C) | 161.7 |
| 8 (C) | 103.8 |
| 9 (C) | 165.2 |
| 10 (C) | 100.1 |
| 1' (C) | 136.8 |
| 2' (CH) | 128 |
| 3' (CH) | 128 |
| 4' (CH) | 129.3 |
| 5' (CH) | 128 |
| 6' (CH) | 129 |
| 6a (CH3) | 7.1 |
| 8a (C) | 197.1 |
| 8b (C) | 105.7 |
| 8c (CH2) | 41.1 |
| 8d (C) | 131 |
| 8e (CH) | 130.5 |
| 8f (CH) | 128.7 |
| 8g (CH) | 127.8 |
| 8h (CH) | 128.7 |
| 8i (CH) | 130.5 |
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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.