Spektraris NMR
Conferone
Common Name: Conferone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C24H28O5/c1-14-5-9-18-23(2,3)19(25)11-12-24(18,4)16(14)13-28-17-8-6-15-7-10-20(26)29-22(15)21(17)27/h5-8,10,16,18,27H,9,11-13H2,1-4H3/t16-,18+,24+/m0/s1
InChIKey: InChIKey=LIPQHBOIEUZBCT-NVTAWBTOSA-N
Formula: C24H28O5
Molecular Weight: 396.477027
Exact Mass: 396.193674
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Zhou, P., Takaishi, Y., Duan, H., Chen, B., Honda, G., Itoh, M., Takeda, Y., Kodzhimatov, O.K., Lee, K.H. Phytochemistry (2000) 53, 689-97
Species:
Notes: Family : Terpenoids, Type : Merosesquiterpenoids, Group : Drimanes; 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) | 38.5 |
| 2 (CH2) | 34.5 |
| 3 (C) | 216.1 |
| 4 (C) | 47.5 |
| 5 (CH) | 51.2 |
| 6 (CH2) | 23.9 |
| 7 (CH) | 123.7 |
| 8 (C) | 132.4 |
| 9 (CH) | 53.1 |
| 10 (C) | 35.9 |
| 11 (CH2) | 66.7 |
| 12 (CH3) | 21.6 |
| 13 (CH3) | 25.3 |
| 14 (CH3) | 22.4 |
| 15 (CH3) | 14.6 |
| 2' (C) | 161.2 |
| 3' (CH) | 113.2 |
| 4' (CH) | 143.4 |
| 5' (CH) | 128.8 |
| 6' (CH) | 113.1 |
| 7' (C) | 161.8 |
| 8' (C) | 101.4 |
| 9' (C) | 156 |
| 10' (C) | 112.7 |
