Spektraris NMR
Tsugafolin
Common Name: Tsugafolin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H16O5/c1-20-12-5-3-10(4-6-12)14-9-13(19)17-15(21-2)7-11(18)8-16(17)22-14/h3-8,14,18H,9H2,1-2H3
InChIKey: InChIKey=KFGFEKHSEPSVNO-UHFFFAOYSA-N
Formula: C17H16O5
Molecular Weight: 300.306587
Exact Mass: 300.099774
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Seidel, V., Bailleul, F., Waterman, P.G. Phytochemistry (2000) 55, 439-46
Species:
Notes: Family : Flavonoids, Type : Flavonoids, Group : Flavanones; 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 (CH) | 79.7 |
| 3 (CH2) | 46.6 |
| 4 (C) | 188.6 |
| 5 (C) | 163.9 |
| 6 (CH) | 95 |
| 7 (C) | 166.6 |
| 8 (CH) | 97.3 |
| 9 (C) | 165.9 |
| 10 (C) | 106.2 |
| 1' (C) | 132.4 |
| 2' (CH) | 128.8 |
| 3' (CH) | 114.9 |
| 4' (C) | 160.7 |
| 5' (CH) | 114.9 |
| 6' (CH) | 128.8 |
| 5a (CH3) | 56.3 |
| 4'a (CH3) | 55.7 |
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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.