Common Name: SalvinorinF
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C21H26O6/c1-20-8-6-14-19(24)27-16(12-7-9-26-11-12)10-21(14,2)17(20)15(22)5-4-13(20)18(23)25-3/h4,7,9,11,14-17,22H,5-6,8,10H2,1-3H3/t14-,15-,16-,17-,20-,21-/m0/s1
InChIKey: InChIKey=GFUASHMLKMINGK-KZVLABISSA-N
Formula: C21H26O6
Molecular Weight: 374.428343
Exact Mass: 374.172939
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Munro, T.A., Rizzacasa, M.A. J Nat Prod (2000) 66, 703-5
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)
Position | PPM |
---|---|
1 (CH) | 63.9 |
2 (CH2) | 38 |
3 (CH) | 133.4 |
4 (C) | 140.6 |
5 (C) | 36.6 |
6 (CH2) | 37.3 |
7 (CH2) | 18.6 |
8 (CH) | 52.2 |
9 (C) | 37.7 |
10 (CH) | 54.8 |
11 (CH2) | 44.4 |
12 (CH) | 71.7 |
13 (C) | 125.9 |
14 (CH) | 108.4 |
15 (CH) | 143.8 |
16 (CH) | 139.3 |
17 (C) | 172.1 |
18 (C) | 166.9 |
19 (CH3) | 21.6 |
20 (CH3) | 16.4 |
18a (CH3) | 51.5 |