Spektraris NMR
(6E)-2a,9a-Epoxyeunicella-6,11(12)-dien-3b-ol
Common Name: (6E)-2a,9a-Epoxyeunicella-6,11(12)-dien-3b-ol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H32O2/c1-12(2)15-9-8-14(4)17-16-11-13(3)7-6-10-20(5,21)19(22-16)18(15)17/h7-8,12,15-19,21H,6,9-11H2,1-5H3/b13-7+/t15?,16-,17-,18-,19-,20-/m1/s1
InChIKey: InChIKey=QFZNULDNHLMPKN-JEKYEMSNSA-N
Formula: C20H32O2
Molecular Weight: 304.467632
Exact Mass: 304.24023
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Maia, L.F., Epifanio, R.A., Eve, T., Fenical, W. J Nat Prod (1999) 62, 1322-4
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Eunicellanes; 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) | 41 |
| 2 (CH) | 90.8 |
| 3 (C) | 77.8 |
| 4 (CH2) | 36.6 |
| 5 (CH2) | 23.3 |
| 6 (CH) | 130.1 |
| 7 (C) | 127.8 |
| 8 (CH2) | 45.5 |
| 9 (CH) | 81.9 |
| 10 (CH) | 48.1 |
| 11 (C) | 134.3 |
| 12 (CH) | 122.2 |
| 13 (CH2) | 23.6 |
| 14 (CH) | 39.4 |
| 15 (CH3) | 27 |
| 16 (CH3) | 18.9 |
| 17 (CH3) | 22 |
| 18 (CH) | 30.4 |
| 19 (CH3) | 21.8 |
| 20 (CH3) | 21.9 |
