Common Name: (4aS)-5alpha-[2-(3-Furyl)ethyl]-1,5,6beta,8abeta-tetramethyl-3,4,4aalpha,5,6,7,8,8a-octahydronaphthalene
Synonyms: (4aS)-5alpha-[2-(3-Furyl)ethyl]-1,5,6beta,8abeta-tetramethyl-3,4,4aalpha,5,6,7,8,8a-octahydronaphthalene
CAS Registry Number:
InChI: InChI=1S/C20H30O/c1-15-6-5-7-18-19(15,3)11-8-16(2)20(18,4)12-9-17-10-13-21-14-17/h6,10,13-14,16,18H,5,7-9,11-12H2,1-4H3/t16-,18+,19+,20+/m0/s1
InChIKey: InChIKey=IVBOCAVCEPSFAH-MTFMMBMASA-N
Formula: C20H30O1
Molecular Weight: 286.452345
Exact Mass: 286.229666
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Imamura, P.M., Costa, M. J Nat Prod (2000) 63, 1623-5
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Clerodanes; 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)
| Position | PPM |
|---|---|
| 1 (CH2) | 18.2 |
| 2 (CH2) | 26.7 |
| 3 (CH) | 120.6 |
| 4 (C) | 143.7 |
| 5 (C) | 37.9 |
| 6 (CH2) | 36.6 |
| 7 (CH2) | 27.4 |
| 8 (CH) | 36.2 |
| 9 (C) | 38.4 |
| 10 (CH) | 46.1 |
| 11 (CH2) | 38.5 |
| 12 (CH2) | 18.2 |
| 13 (C) | 125.2 |
| 14 (CH) | 110.7 |
| 15 (CH) | 142.3 |
| 16 (CH) | 138 |
| 17 (CH3) | 16.1 |
| 18 (CH3) | 17.9 |
| 19 (CH3) | 19.8 |
| 20 (CH3) | 18.2 |