Spektraris NMR
Furanocembranoid 1
Common Name: Furanocembranoid 1
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O2/c1-15(2)18-8-7-17-13-19(22-14-17)12-16(3)6-5-10-20(4,21)11-9-18/h6,9,11,13-15,18,21H,5,7-8,10,12H2,1-4H3/b11-9+,16-6+/t18-,20+/m1/s1
InChIKey: InChIKey=SERTTYWXOQCADY-KKUMVBAPSA-N
Formula: C20H30O2
Molecular Weight: 302.45175
Exact Mass: 302.22458
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Pudhom, K., Vilaivan, T., Ngamrojanavanich, N., Dechangvipart, S., Sommit, D., Petsom, A., Roengsumran, S. J Nat Prod (2007) 70, 659-61
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 (CH) | 47 |
| 2 (CH) | 129.6 |
| 3 (CH) | 137.6 |
| 4 (C) | 73 |
| 5 (CH2) | 42.6 |
| 6 (CH2) | 22.8 |
| 7 (CH) | 124.9 |
| 8 (C) | 132.5 |
| 9 (CH2) | 36.4 |
| 10 (C) | 154 |
| 11 (CH) | 109.6 |
| 12 (C) | 125.7 |
| 13 (CH2) | 24.8 |
| 14 (CH2) | 33.7 |
| 15 (CH) | 33.4 |
| 16 (CH3) | 19.7 |
| 17 (CH3) | 20.7 |
| 18 (CH3) | 31.2 |
| 19 (CH3) | 17.3 |
| 20 (CH) | 137.8 |
