Spektraris NMR
Myricetin 3-O-β-D-galactopyranoside
Common Name: Myricetin 3-O-β-D-galactopyranoside
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C21H20O13/c22-5-12-15(28)17(30)18(31)21(33-12)34-20-16(29)13-8(24)3-7(23)4-11(13)32-19(20)6-1-9(25)14(27)10(26)2-6/h1-4,12,15,17-18,21-28,30-31H,5H2/t12-,15+,17+,18-,21+/m1/s1
InChIKey: InChIKey=FOHXFLPXBUAOJM-MGMURXEASA-N
Formula: C21H20O13
Molecular Weight: 480.376533
Exact Mass: 480.090391
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - Foo, L.Y., Lu, Y., Molan, A.L., Woodfield, D.R., McNabb, W.C. Phytochemistry (2000) 54, 539-48
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) | 156.6 |
| 3 (C) | 134.1 |
| 4 (C) | 177.7 |
| 5 (C) | 161.6 |
| 6 (CH) | 99.1 |
| 7 (C) | 164.7 |
| 8 (CH) | 93.7 |
| 9 (C) | 156.6 |
| 10 (C) | 104.2 |
| 1' (C) | 120.3 |
| 2' (CH) | 108.9 |
| 3' (C) | 145.7 |
| 4' (C) | 137 |
| 5' (C) | 145.7 |
| 6' (CH) | 108.9 |
| 1'' (CH) | 102.4 |
| 2'' (CH) | 71.6 |
| 3'' (CH) | 73.7 |
| 4'' (CH) | 68.3 |
| 5'' (CH) | 76.3 |
| 6'' (CH2) | 60.4 |
