Spektraris NMR
Integrifoside A
Common Name: Integrifoside A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C21H36O9/c1-19(2,28)10-7-13-20(3,8-11(10)23)6-5-14(24)21(13,4)30-18-17(27)16(26)15(25)12(9-22)29-18/h10,12-18,22,24-28H,5-9H2,1-4H3/t10-,12+,13+,14-,15+,16-,17+,18-,20+,21-/m0/s1
InChIKey: InChIKey=OEXMOKNCZIWALN-UUVGVEKZSA-N
Formula: C21H36O9
Molecular Weight: 432.505965
Exact Mass: 432.235933
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Ono, M., Masuoka, C., Odake, Y., Ito, Y., Nohara, T. Phytochemistry (2000) 53, 479-84
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eudesmanes; 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 (CH2) | 38.5 |
| 2 (CH2) | 27.5 |
| 3 (CH) | 73.2 |
| 4 (C) | 83.6 |
| 5 (CH) | 48.6 |
| 6 (CH2) | 24.4 |
| 7 (CH) | 60.5 |
| 8 (C) | 211.5 |
| 9 (CH2) | 60.4 |
| 10 (C) | 40.5 |
| 11 (C) | 70.9 |
| 12 (CH3) | 25.3 |
| 13 (CH3) | 29.3 |
| 14 (CH3) | 19.9 |
| 15 (CH3) | 16.3 |
| 1' (CH) | 95.7 |
| 2' (CH) | 76 |
| 3' (CH) | 78.7 |
| 4' (CH) | 72.1 |
| 5' (CH) | 79.2 |
| 6' (CH2) | 63.2 |
