Spektraris NMR
(2Z,6Z,10E)-Cericerene-15,24-diol
Common Name: (2Z,6Z,10E)-Cericerene-15,24-diol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C25H42O2/c1-20(2)9-8-18-25(5,27)24-16-14-21(3)10-6-12-23(19-26)13-7-11-22(4)15-17-24/h9-10,13,15,24,26-27H,6-8,11-12,14,16-19H2,1-5H3/b21-10+,22-15-,23-13-/t24-,25?/m0/s1
InChIKey: InChIKey=VUURSWUKVPJIET-LSEAAVOSSA-N
Formula: C25H42O2
Molecular Weight: 374.600719
Exact Mass: 374.318481
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Toki, M., Ooi, T., Kusumi, T. J Nat Prod (1999) 62, 1504-9
Species:
Notes: Family : Terpenoids, Type : Sesterterpenoids, Group : Cericerenes; 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) | 29 |
| 2 (CH) | 126.4 |
| 3 (C) | 134.2 |
| 4 (CH2) | 24.5 |
| 5 (CH2) | 30.2 |
| 6 (CH) | 129.2 |
| 7 (C) | 134.1 |
| 8 (CH2) | 35.1 |
| 9 (CH2) | 24.3 |
| 10 (CH) | 125.9 |
| 11 (C) | 136.4 |
| 12 (CH2) | 38.9 |
| 13 (CH2) | 28.1 |
| 14 (CH) | 47.2 |
| 15 (C) | 75.7 |
| 16 (CH2) | 39.7 |
| 17 (CH2) | 22.1 |
| 18 (CH) | 124.6 |
| 19 (C) | 131.6 |
| 20 (CH3) | 25.6 |
| 21 (CH3) | 17.6 |
| 22 (CH3) | 23.6 |
| 23 (CH3) | 22.1 |
| 24 (CH2) | 60 |
| 25 (CH3) | 15.4 |
