Spektraris NMR
ent-Atisane-16a-ol
Common Name: ent-Atisane-16a-ol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H34O/c1-17(2)8-5-9-18(3)15(17)7-11-20-10-6-14(12-16(18)20)19(4,21)13-20/h14-16,21H,5-13H2,1-4H3/t14-,15+,16-,18+,19-,20+/m0/s1
InChIKey: InChIKey=FUZRTCOJTDNSGD-YDMLNEHTSA-N
Formula: C20H34O1
Molecular Weight: 290.484108
Exact Mass: 290.260966
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Konishi, T., Yamazoe, K., Kanzato, M., Konoshima, T., Fujiwara, Y. Chem Pharm Bull (2003) 51, 1142-6
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Atisanes; 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) | 39.3 |
| 2 (CH2) | 18.7 |
| 3 (CH2) | 42.2 |
| 4 (C) | 33.1 |
| 5 (CH) | 56.4 |
| 6 (CH2) | 18.2 |
| 7 (CH2) | 39.7 |
| 8 (C) | 33.8 |
| 9 (CH) | 51.3 |
| 10 (C) | 37.1 |
| 11 (CH2) | 24.1 |
| 12 (CH) | 37.9 |
| 13 (CH2) | 23.2 |
| 14 (CH2) | 27.3 |
| 15 (CH2) | 57.7 |
| 16 (C) | 72.2 |
| 17 (CH3) | 30.4 |
| 18 (CH3) | 33.4 |
| 19 (CH3) | 21.7 |
| 20 (CH3) | 13.9 |
