Spektraris NMR
Teutrifidin
Common Name: Teutrifidin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H24O9/c1-11-17(25)18(26)21(9-29-12(2)23)15(3-4-16(24)22(21)10-30-22)20(11)7-14(31-19(20)27)13-5-6-28-8-13/h5-6,8,11,14-15,17,25H,3-4,7,9-10H2,1-2H3/t11-,14+,15-,17-,20-,21+,22-/m1/s1
InChIKey: InChIKey=RWDUFUWSPLPCBX-ZNDGPWFTSA-N
Formula: C22H24O9
Molecular Weight: 432.421412
Exact Mass: 432.142032
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Daviescoleman, M.T., Hanson, J.R., Rivett, D.E.A. Phytochemistry (1994) 36, 1549-50
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Clerodanes; 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) | 22.4 |
| 2 (CH2) | 39 |
| 3 (C) | 202.2 |
| 4 (C) | 63.8 |
| 5 (C) | 53 |
| 6 (C) | 206.3 |
| 7 (CH) | 72.9 |
| 8 (CH) | 48.4 |
| 9 (C) | 53 |
| 10 (CH) | 52.6 |
| 11 (CH2) | 43.5 |
| 12 (CH) | 72.8 |
| 13 (C) | 124.4 |
| 14 (CH) | 107.8 |
| 15 (CH) | 144.6 |
| 16 (CH) | 139.7 |
| 17 (CH3) | 13.5 |
| 18 (CH2) | 50.6 |
| 19 (CH2) | 63.2 |
| 20 (C) | 176.1 |
| 19a (C) | 169.3 |
| 19b (CH3) | 20.5 |
