Spektraris NMR
3'-Hydroxymelanetin
Common Name: 3'-Hydroxymelanetin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C16H12O6/c1-21-15-7-14-10(5-13(15)19)9(6-16(20)22-14)8-2-3-11(17)12(18)4-8/h2-7,17-19H,1H3
InChIKey: InChIKey=IGHVYQBBZBLNDW-UHFFFAOYSA-N
Formula: C16H12O6
Molecular Weight: 300.263493
Exact Mass: 300.063388
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) | 160.99 |
| 3 (CH) | 110.59 |
| 4 (C) | 155.72 |
| 5 (CH) | 111.11 |
| 6 (C) | 143.79 |
| 7 (C) | 152.12 |
| 8 (CH) | 100.89 |
| 9 (C) | 148.83 |
| 10 (C) | 111.49 |
| 1' (C) | 126.68 |
| 2' (CH) | 116.26 |
| 3' (C) | 145.81 |
| 4' (C) | 147.41 |
| 5' (CH) | 120.26 |
| 6' (CH) | 116.08 |
| 7a (CH3) | 56.55 |
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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.