Common Name: (3R,4aalpha)-3,8beta-Dimethyl-4alpha-ethoxy-5alpha-isopropyldecalin-3beta,8aalpha-diol
Synonyms: (3R,4aalpha)-3,8beta-Dimethyl-4alpha-ethoxy-5alpha-isopropyldecalin-3beta,8aalpha-diol
CAS Registry Number:
InChI: InChI=1S/C17H32O3/c1-6-20-15-14-13(11(2)3)8-7-12(4)17(14,19)10-9-16(15,5)18/h11-15,18-19H,6-10H2,1-5H3/t12-,13+,14-,15-,16-,17+/m1/s1
InChIKey: InChIKey=MQOGRIRJXIYHKV-GGGWTEGZSA-N
Formula: C17H32O3
Molecular Weight: 284.434829
Exact Mass: 284.235145
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Kuo, Y.H., Chen, C.H., Chien, S.C., Lin, Y.L. J Nat Prod (2002) 65, 25-8
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Muurolanes; 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 (C) | 74.7 |
2 (CH2) | 32.1 |
3 (CH2) | 25 |
4 (C) | 75.6 |
5 (CH) | 72.3 |
6 (CH) | 42.5 |
7 (CH) | 37.4 |
8 (CH2) | 23.7 |
9 (CH2) | 30.4 |
10 (CH) | 41.1 |
11 (CH) | 25.6 |
12 (CH3) | 14.9 |
13 (CH3) | 21.5 |
14 (CH3) | 14.1 |
15 (CH3) | 21.7 |
5a (CH2) | 55.9 |
5b (CH3) | 16.2 |