Common Name: (1S,2S,7S,9S,10S,13S)-9-Hydroxy-2,6,6,13-tetramethyltetracyclo[11.2.1.01,10.02,7]hexadecan-12-one
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H32O2/c1-17(2)6-5-7-19(4)15(17)11-14(21)13-10-16(22)18(3)8-9-20(13,19)12-18/h13-15,21H,5-12H2,1-4H3/t13-,14+,15+,18+,19+,20+/m1/s1
InChIKey: InChIKey=LXEGOHKTTPPNIV-LUCRAQOWSA-N
Formula: C20H32O2
Molecular Weight: 304.467632
Exact Mass: 304.24023
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Gonzalez, M.A., Zaragoza, R.J. Magn Reson Chem (2005) 43, 877-80
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Thyrsifloranes; 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) | 32.33 |
2 (CH2) | 18.59 |
3 (CH2) | 41.84 |
4 (C) | 33.08 |
5 (CH) | 46.34 |
6 (CH2) | 32.02 |
7 (CH) | 73.91 |
8 (CH) | 47.34 |
9 (C) | 52.46 |
10 (C) | 38.81 |
11 (CH2) | 45.19 |
12 (C) | 53.62 |
13 (C) | 213.77 |
14 (CH2) | 40.13 |
15 (CH2) | 36.73 |
16 (CH2) | 25.57 |
17 (CH3) | 19.69 |
18 (CH3) | 33.5 |
19 (CH3) | 21.91 |
20 (CH3) | 17.47 |