Spektraris NMR
Kaempferol 3-O-[2-O-(6-O-E-feruloyl)-β-D-glucopyranosyl]-β-D-galactopyranoside
![Kaempferol 3-O-[2-O-(6-O-E-feruloyl)-β-D-glucopyranosyl]-β-D-galactopyranoside](/nmr/static/nmr/svg/11632.svg)
Common Name: Kaempferol 3-O-[2-O-(6-O-E-feruloyl)-β-D-glucopyranosyl]-β-D-galactopyranoside
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C37H38O19/c1-50-21-10-15(2-8-19(21)41)3-9-25(43)51-14-24-28(45)30(47)32(49)36(54-24)56-35-31(48)27(44)23(13-38)53-37(35)55-34-29(46)26-20(42)11-18(40)12-22(26)52-33(34)16-4-6-17(39)7-5-16/h2-12,23-24,27-28,30-32,35-42,44-45,47-49H,13-14H2,1H3/b9-3+/t23-,24-,27+,28-,30+,31+,32-,35-,36+,37+/m1/s1
InChIKey: InChIKey=ZVSLMENFANKRLA-YOSJVENPSA-N
Formula: C37H38O19
Molecular Weight: 786.68767
Exact Mass: 786.200729
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - Kim, Y., Park, E.J., Kim, J., Kim, S.R., Kim, Y.Y. J Nat Prod (2001) 64, 75-8
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) | 156.2 |
| 3 (C) | 132.9 |
| 4 (C) | 177.4 |
| 5 (C) | 161.2 |
| 6 (CH) | 98.6 |
| 7 (C) | 164.1 |
| 8 (CH) | 93.6 |
| 9 (C) | 155.4 |
| 10 (C) | 103.8 |
| 1' (C) | 120.8 |
| 2' (CH) | 131 |
| 3' (CH) | 115.2 |
| 4' (C) | 159.9 |
| 5' (CH) | 115.2 |
| 6' (CH) | 131 |
| 1'' (CH) | 98.4 |
| 2'' (CH) | 81.1 |
| 3'' (CH) | 73.3 |
| 4'' (CH) | 67.5 |
| 5'' (CH) | 76.2 |
| 6'' (CH2) | 59.8 |
| 1''' (CH) | 104.5 |
| 2''' (CH) | 74.5 |
| 3''' (CH) | 75.8 |
| 4''' (CH) | 69.5 |
| 5''' (CH) | 74 |
| 6''' (CH2) | 63.3 |
| 1'''' (C) | 125.4 |
| 2'''' (CH) | 110.9 |
| 3'''' (C) | 147.8 |
| 4'''' (C) | 149.2 |
| 5'''' (CH) | 115.3 |
| 6'''' (CH) | 122.9 |
| 7'''' (CH) | 145 |
| 8'''' (CH) | 113.9 |
| 9'''' (C) | 166.5 |
| 3''''a (CH3) | 55.6 |
