Spektraris NMR
(9S,10S:13S,14S)-Ent-9,10:13,14-diepoxyverticillol
Common Name: (9S,10S:13S,14S)-Ent-9,10:13,14-diepoxyverticillol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H34O3/c1-17(2)13-6-9-18(3,21)14(17)7-10-19(4)15(22-19)8-11-20(5)16(12-13)23-20/h13-16,21H,6-12H2,1-5H3/t13-,14+,15-,16-,18-,19-,20-/m0/s1
InChIKey: InChIKey=QAKDMKNAZDPAHI-HOSJZOFRSA-N
Formula: C20H34O3
Molecular Weight: 322.482918
Exact Mass: 322.250795
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Nagashima, F., Kishi, K., Hamada, Y., Takaoka, S., Asakawa, Y. Phytochemistry (2005) 66, 1662-70
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Verticillanes; 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) | 42.5 |
| 2 (CH2) | 34.3 |
| 3 (CH) | 64.7 |
| 4 (C) | 63.2 |
| 5 (CH2) | 37.9 |
| 6 (CH2) | 24 |
| 7 (CH) | 65.5 |
| 8 (C) | 61.7 |
| 9 (CH2) | 39.1 |
| 10 (CH2) | 21.3 |
| 11 (CH) | 46.6 |
| 12 (C) | 75.1 |
| 13 (CH2) | 41.4 |
| 14 (CH2) | 27.5 |
| 15 (C) | 36.9 |
| 16 (CH3) | 30.6 |
| 17 (CH3) | 24.4 |
| 18 (CH3) | 25.4 |
| 19 (CH3) | 16.9 |
| 20 (CH3) | 15.8 |
