(12Z)-Labda-8(20),12,14-trien-3beta-ol

(12Z)-Labda-8(20),12,14-trien-3beta-ol

Common Name: (12Z)-Labda-8(20),12,14-trien-3beta-ol

Synonyms: (12Z)-Labda-8(20),12,14-trien-3beta-ol

CAS Registry Number:

InChI: InChI=1S/C20H32O/c1-7-14(2)8-10-16-15(3)9-11-17-19(4,5)18(21)12-13-20(16,17)6/h7-8,16-18,21H,1,3,9-13H2,2,4-6H3/b14-8-/t16-,17-,18-,20+/m0/s1

InChIKey: InChIKey=QSFSRHYSSAIFJK-DUTLMNFUSA-N

Formula: C20H32O1

Molecular Weight: 288.468227

Exact Mass: 288.245316

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Furlan, M., Lopes, M.N., Fernandes, J.B., Pirani, J.R. Phytochemistry (1996) 41, 1159-61

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Labdanes; 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) 37.9
2 (CH2) 27.9
3 (CH) 78.8
4 (C) 39.1
5 (CH) 54.5
6 (CH2) 23.6
7 (CH2) 37.2
8 (C) 147.9
9 (CH) 57
10 (C) 39.3
11 (CH2) 22.3
12 (CH) 133.6
13 (C) 131.7
14 (CH) 131.5
15 (CH2) 113.3
16 (CH3) 19.7
17 (CH2) 108
18 (CH3) 28.6
19 (CH3) 15.4
20 (CH3) 14.5