Spektraris NMR
4-O-Methyl guaiacylglycerol 9-O-beta-glucopyranoside
Common Name: 4-O-Methyl guaiacylglycerol 9-O-beta-glucopyranoside
Synonyms: 4-O-Methyl guaiacylglycerol 9-O-beta-glucopyranoside
CAS Registry Number:
InChI: InChI=1S/C17H26O10/c1-24-10-4-3-8(5-11(10)25-2)13(20)9(19)7-26-17-16(23)15(22)14(21)12(6-18)27-17/h3-5,9,12-23H,6-7H2,1-2H3/t9?,12-,13?,14-,15+,16-,17-/m1/s1
InChIKey: InChIKey=UBFSPQXFYOBOKD-ALOQOGBISA-N
Formula: C17H26O10
Molecular Weight: 390.383019
Exact Mass: 390.152597
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - Mohamed, K.M. Phytochemistry (2001) 58, 615-8
Species:
Notes: Family : Aromatics, Type : Phenyl-alkanoids, Group : Phenylpropanoids; 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) | 136 |
| 2 (CH) | 111.3 |
| 3 (C) | 148.2 |
| 4 (C) | 148.7 |
| 5 (CH) | 111.8 |
| 6 (CH) | 119.2 |
| 7 (CH) | 72.9 |
| 8 (CH) | 74.1 |
| 9 (CH2) | 71.3 |
| 1' (CH) | 104.1 |
| 2' (CH) | 74.4 |
| 3' (CH) | 76.9 |
| 4' (CH) | 70.5 |
| 5' (CH) | 77.3 |
| 6' (CH2) | 61.5 |
| 3a (CH3) | 55.9 |
| 4a (CH3) | 56 |
