Spektraris NMR
13-epi-neoverrucosan-5β-ol
Common Name: 13-epi-neoverrucosan-5β-ol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H34O/c1-12(2)13-6-7-18(3)8-9-19(4)11-15(21)20(5)10-14(20)17(19)16(13)18/h12-17,21H,6-11H2,1-5H3/t13-,14+,15-,16-,17-,18-,19+,20+/m1/s1
InChIKey: InChIKey=JXDKJHNZVVRXON-QOFRVKGVSA-N
Formula: C20H34O1
Molecular Weight: 290.484108
Exact Mass: 290.260966
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Toyota, M., Nakaishi, E., Asakawa, Y. Phytochemistry (1996) 43, 1057-64
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Neoverrucosanes; 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) | 45.8 |
| 2 (CH) | 27.5 |
| 3 (CH2) | 20.2 |
| 4 (C) | 23.3 |
| 5 (CH) | 71.4 |
| 6 (CH2) | 47 |
| 7 (C) | 37.5 |
| 8 (CH2) | 35.3 |
| 9 (CH2) | 36.6 |
| 10 (C) | 42.5 |
| 11 (CH2) | 40.9 |
| 12 (CH2) | 25.3 |
| 13 (CH) | 29.8 |
| 14 (CH) | 50.6 |
| 15 (CH) | 44.9 |
| 16 (CH3) | 21.3 |
| 17 (CH3) | 23.9 |
| 18 (CH3) | 25.6 |
| 19 (CH3) | 17.1 |
| 20 (CH3) | 20.3 |
