Spektraris NMR
Melanetin
Common Name: Melanetin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C16H12O5/c1-20-15-8-14-12(6-13(15)18)11(7-16(19)21-14)9-2-4-10(17)5-3-9/h2-8,17-18H,1H3
InChIKey: InChIKey=HUGUGFBIYQBLCS-UHFFFAOYSA-N
Formula: C16H12O5
Molecular Weight: 284.264088
Exact Mass: 284.068473
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - Chan S.C., Chang Y.S., Kuo S.C. Phytochemistry (1997) 46, 947
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) | 160.39 |
| 3 (CH) | 110.28 |
| 4 (C) | 155.03 |
| 5 (CH) | 110.62 |
| 6 (C) | 143.34 |
| 7 (C) | 151.67 |
| 8 (CH) | 100.43 |
| 9 (C) | 148.33 |
| 10 (C) | 111.06 |
| 1' (C) | 125.76 |
| 2' (CH) | 129.76 |
| 3' (CH) | 115.48 |
| 4' (C) | 158.67 |
| 5' (CH) | 115.48 |
| 6' (CH) | 129.76 |
| 7a (CH3) | 56.04 |
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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.