Spektraris NMR
Sagittines G
Common Name: Sagittines G
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H32O3/c1-5-17(2)11-12-18(3)14(13-17)8-10-20(23)15(18)7-6-9-19(20,4)16(21)22/h5,14-15,23H,1,6-13H2,2-4H3,(H,21,22)/t14-,15+,17-,18-,19+,20-/m0/s1
InChIKey: InChIKey=MXGSLCNVYMDELJ-MRLXWHFUSA-N
Formula: C20H32O3
Molecular Weight: 320.467037
Exact Mass: 320.235145
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Liu, X.T., Pan, Q., Shi, Y., Williams, I.D., Sung, H.H., Zhang, Q., Liang, J.Y., Ip, N.Y., Min, Z.D. J Nat Prod (2006) 69, 255-60
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Rosanes; 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) | 23 |
| 2 (CH2) | 20.4 |
| 3 (CH2) | 33.7 |
| 4 (C) | 51.8 |
| 5 (C) | 75 |
| 6 (CH2) | 33.6 |
| 7 (CH2) | 25 |
| 8 (CH) | 40.7 |
| 9 (C) | 36.3 |
| 10 (CH) | 49.3 |
| 11 (CH2) | 34.8 |
| 12 (CH2) | 31.9 |
| 13 (C) | 36.6 |
| 14 (CH2) | 39.1 |
| 15 (CH) | 151.3 |
| 16 (CH2) | 108.6 |
| 17 (CH3) | 23.1 |
| 18 (CH3) | 20.1 |
| 19 (C) | 182.3 |
| 20 (CH3) | 12.2 |
