Spektraris NMR
2,6-Dihydroxy-4-methoxyphenyl 2-O-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-β-D-glucopyranoside
![2,6-Dihydroxy-4-methoxyphenyl 2-O-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-β-D-glucopyranoside](/nmr/static/nmr/svg/6668.svg)
Common Name: 2,6-Dihydroxy-4-methoxyphenyl 2-O-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-β-D-glucopyranoside
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C18H26O13/c1-27-7-2-8(21)13(9(22)3-7)30-16-14(12(24)11(23)10(4-19)29-16)31-17-15(25)18(26,5-20)6-28-17/h2-3,10-12,14-17,19-26H,4-6H2,1H3/t10-,11-,12+,14-,15+,16+,17+,18-/m1/s1
InChIKey: InChIKey=CSDQHVCZYMGVLN-HEKGSVBLSA-N
Formula: C18H26O13
Molecular Weight: 450.39197
Exact Mass: 450.137341
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Calis, I., Gazar, H.A., Piacente, S., Pizza, C. J Nat Prod (2001) 64, 1179-82
Species:
Notes: Family : Aromatics, Type : Benzenes; 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 |
|---|---|
| 1 (C) | 155 |
| 2 (C) | 128.9 |
| 3 (C) | 155 |
| 4 (CH) | 94.6 |
| 5 (C) | 155.7 |
| 6 (CH) | 94.6 |
| 1' (CH) | 103.3 |
| 2' (CH) | 78.7 |
| 3' (CH) | 78.7 |
| 4' (CH) | 71.4 |
| 5' (CH) | 77.9 |
| 6' (CH2) | 62.6 |
| 1'' (CH) | 110.4 |
| 2'' (CH) | 78.1 |
| 3'' (C) | 80.9 |
| 4'' (CH2) | 75.6 |
| 5'' (CH2) | 66.4 |
| 5aa (CH3) | 56.8 |
