Spektraris NMR
6-Hydroxy-junipeionoloside
Common Name: 6-Hydroxy-junipeionoloside
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C19H30O9/c1-10-6-12(22)7-18(3,19(10,26)5-4-11(2)21)9-27-17-16(25)15(24)14(23)13(8-20)28-17/h4-6,11,13-17,20-21,23-26H,7-9H2,1-3H3/b5-4+/t11-,13-,14-,15+,16-,17-,18+,19+/m1/s1
InChIKey: InChIKey=UUUMPMJOJKTIFJ-DTVIAPSXSA-N
Formula: C19H30O9
Molecular Weight: 402.436849
Exact Mass: 402.188983
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Champavier, Y., Comte, G., Vercauteren, J., Allais, D.P., Chulia, A.J. Phytochemistry (1999) 50, 1219-23
Species:
Notes: Family : Terpenoids, Type : Miscellanea, Group : Megastigmanes; 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) | 46.3 |
| 2 (CH2) | 45.5 |
| 3 (C) | 202.1 |
| 4 (CH) | 128.5 |
| 5 (C) | 168.2 |
| 6 (C) | 79.4 |
| 7 (CH) | 130.6 |
| 8 (CH) | 138 |
| 9 (CH) | 68.7 |
| 10 (CH3) | 23.8 |
| 11 (CH2) | 74.6 |
| 12 (CH3) | 20.1 |
| 13 (CH3) | 19.5 |
| 1' (CH) | 104.6 |
| 2' (CH) | 75.1 |
| 3' (CH) | 78.1 |
| 4' (CH) | 71.5 |
| 5' (CH) | 78 |
| 6' (CH2) | 62.7 |
