Spektraris NMR
ent-4beta-hydroxy-10alpha-methoxyaromadendrane
Common Name: ent-4beta-hydroxy-10alpha-methoxyaromadendrane
Synonyms: ent-4beta-hydroxy-10alpha-methoxyaromadendrane
CAS Registry Number:
InChI: InChI=1S/C16H28O2/c1-14(2)10-7-9-16(4,18-5)11-6-8-15(3,17)13(11)12(10)14/h10-13,17H,6-9H2,1-5H3/t10-,11-,12-,13-,15+,16-/m0/s1
InChIKey: InChIKey=VIUVKKQOGAFVMN-QNSZCRRISA-N
Formula: C16H28O2
Molecular Weight: 252.392925
Exact Mass: 252.20893
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Liu, H.J., Wu, C.L., Becker, H., Zapp, J. Phytochemistry (2000) 53, 845-9
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Aromadendranes; 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) | 52.2 |
| 2 (CH2) | 23.6 |
| 3 (CH2) | 41.1 |
| 4 (C) | 80.3 |
| 5 (CH) | 48.1 |
| 6 (CH) | 28.1 |
| 7 (CH) | 26.7 |
| 8 (CH2) | 19.8 |
| 9 (CH2) | 37.5 |
| 10 (C) | 79 |
| 11 (C) | 19.7 |
| 12 (CH3) | 28.7 |
| 13 (CH3) | 16.5 |
| 14 (CH3) | 17.7 |
| 15 (CH3) | 24.4 |
| 10a (CH3) | 48.3 |
