(1S,2S,7S,9S,10S,12S,13S)-12-Hydroxy-2,6,6,13-tetramethyltetracyclo[11.2.1.01,10.02,7]hexadec-9-yl acetate

(1S,2S,7S,9S,10S,12S,13S)-12-Hydroxy-2,6,6,13-tetramethyltetracyclo[11.2.1.01,10.02,7]hexadec-9-yl acetate

Common Name: (1S,2S,7S,9S,10S,12S,13S)-12-Hydroxy-2,6,6,13-tetramethyltetracyclo[11.2.1.01,10.02,7]hexadec-9-yl acetate

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C22H36O3/c1-14(23)25-16-12-17-19(2,3)7-6-8-21(17,5)22-10-9-20(4,13-22)18(24)11-15(16)22/h15-18,24H,6-13H2,1-5H3/t15-,16+,17+,18+,20+,21+,22+/m1/s1

InChIKey: InChIKey=ORLINPYCQIFYCV-RNXAVOFCSA-N

Formula: C22H36O3

Molecular Weight: 348.520272

Exact Mass: 348.266445

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)

Carbon NMR Peaks

Position PPM
1 (CH2) 32.11
2 (CH2) 18.63
3 (CH2) 41.96
4 (C) 33.17
5 (CH) 45.92
6 (CH2) 28.05
7 (CH) 76.58
8 (CH) 38.3
9 (C) 53.99
10 (C) 38.56
11 (CH2) 37.68
12 (C) 43.73
13 (CH) 74.49
14 (CH2) 33.1
15 (CH2) 36.27
16 (CH2) 24.24
17 (CH3) 23.85
18 (CH3) 33.51
19 (CH3) 22.04
20 (CH3) 17.71
7a (C) 171.07
7b (CH3) 21.34