Spektraris NMR
Salvinorin C
Common Name: Salvinorin C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C23H28O10/c1-11(24)32-15-10-14(21(30)31-4)23(3)8-6-13(19(27)28)22(2,18(23)17(15)26)7-5-12-9-16(25)33-20(12)29/h5,7,9,13-15,18,20,29H,6,8,10H2,1-4H3,(H,27,28)/b7-5+/t13-,14-,15-,18+,20?,22-,23-/m0/s1
InChIKey: InChIKey=JLLALLSXASKWMT-JYYNUABRSA-N
Formula: C23H28O10
Molecular Weight: 464.463316
Exact Mass: 464.168247
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Shirota, O., Nagamatsu, K., Sekita, S. J Nat Prod (2006) 69, 1782-6
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 (C) | 203.9 |
| 2 (CH) | 77 |
| 3 (CH2) | 32.2 |
| 4 (CH) | 54.1 |
| 5 (C) | 43.6 |
| 6 (CH2) | 38.8 |
| 7 (CH2) | 22 |
| 8 (CH) | 54.1 |
| 9 (C) | 42.5 |
| 10 (CH) | 61.6 |
| 11 (CH) | 152.6 |
| 12 (CH) | 120.4 |
| 13 (C) | 164.3 |
| 14 (CH) | 116.5 |
| 15 (C) | 173.7 |
| 16 (CH) | 99.9 |
| 17 (C) | 176.2 |
| 18 (C) | 173.6 |
| 19 (CH3) | 16.4 |
| 20 (CH3) | 15.9 |
| 2a (C) | 171.6 |
| 2b (CH3) | 20.5 |
| 18a (CH3) | 52.2 |
