Spektraris NMR
Sarcophytolide
Common Name: Sarcophytolide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H28O3/c1-13-7-5-8-14(2)11-17-16(15(3)19(21)22-17)12-18-20(4,23-18)10-6-9-13/h9,11,17-18H,5-8,10,12H2,1-4H3/b13-9+,14-11+/t17-,18+,20+/m0/s1
InChIKey: InChIKey=ISKFGXBHTRFKOF-YVYZIZKDSA-N
Formula: C20H28O3
Molecular Weight: 316.435274
Exact Mass: 316.203845
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Badria, F.A., Guirguis, A.N., Perovic, S., Steffen, R., Muller, W.E., Schroder, H.C. Toxicology (1998) 131, 133-43
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Cembranes; 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) | 162 |
| 2 (CH2) | 27 |
| 3 (CH) | 61 |
| 4 (C) | 59 |
| 5 (CH2) | 39 |
| 6 (CH2) | 23.2 |
| 7 (CH) | 124.9 |
| 8 (C) | 135 |
| 9 (CH2) | 37.4 |
| 10 (CH2) | 25.2 |
| 11 (CH2) | 37.4 |
| 12 (C) | 144 |
| 13 (CH) | 120.6 |
| 14 (CH) | 78 |
| 15 (C) | 122.9 |
| 16 (C) | 174 |
| 17 (CH3) | 15 |
| 18 (CH3) | 17 |
| 19 (CH3) | 15.9 |
| 20 (CH3) | 9 |
