Spektraris NMR
Tupichinol E
Common Name: Tupichinol E
Synonyms: Tupichinol E
CAS Registry Number:
InChI: InChI=1S/C17H14O6/c1-8-12(22-2)7-11(19)13-14(20)15(21)17(23-16(8)13)9-3-5-10(18)6-4-9/h3-7,18-19,21H,1-2H3
InChIKey: InChIKey=HCRLNUIDURQGLT-UHFFFAOYSA-N
Formula: C17H14O6
Molecular Weight: 314.29011
Exact Mass: 314.079038
NMR Solvent: CD3COCD3
MHz:
Calibration:
NMR references: 13C - Pan, W.B., Wei, L.M., Wei, L.L., Wu, Y.C. Chem Pharm Bull (2006) 54, 954-8
Species:
Notes: Family : Flavonoids, Type : Flavonoids, Group : Flavonols; 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) | 144 |
| 3 (C) | 132.7 |
| 4 (C) | 177.8 |
| 5 (C) | 160.9 |
| 6 (CH) | 95.7 |
| 7 (C) | 164.7 |
| 8 (C) | 104.2 |
| 9 (C) | 147.9 |
| 10 (C) | 105.1 |
| 1' (C) | 124.3 |
| 2' (CH) | 131.2 |
| 3' (CH) | 117.1 |
| 4' (C) | 148.2 |
| 5' (CH) | 117.1 |
| 6' (CH) | 131.2 |
| 7a (CH3) | 57.4 |
| 8a (CH3) | 8.4 |
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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.