(1R,3E,7E,11R)-4,8,12,15,15-Pentamethylbicyclo[9.3.1]pentadeca-3,7-diene-6alpha,12alpha-diol

(1R,3E,7E,11R)-4,8,12,15,15-Pentamethylbicyclo[9.3.1]pentadeca-3,7-diene-6alpha,12alpha-diol

Common Name: (1R,3E,7E,11R)-4,8,12,15,15-Pentamethylbicyclo[9.3.1]pentadeca-3,7-diene-6alpha,12alpha-diol

Synonyms: (1R,3E,7E,11R)-4,8,12,15,15-Pentamethylbicyclo[9.3.1]pentadeca-3,7-diene-6alpha,12alpha-diol

CAS Registry Number:

InChI: InChI=1S/C20H34O2/c1-14-6-8-16-10-11-20(5,22)18(19(16,3)4)9-7-15(2)13-17(21)12-14/h6,13,16-18,21-22H,7-12H2,1-5H3/b14-6+,15-13+/t16-,17-,18+,20+/m0/s1

InChIKey: InChIKey=ZFZJGHUIXOHECQ-CBAGNANHSA-N

Formula: C20H34O2

Molecular Weight: 306.483513

Exact Mass: 306.25588

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Nagashima, F., Wakayama, K., Ioka, Y., Asakawa, Y. Chem Pharm Bull (2008) 56, 1184-8

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Verticillanes; 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 (CH) 43.9
2 (CH2) 34
3 (CH) 129.8
4 (C) 130
5 (CH2) 50
6 (CH) 67.6
7 (CH) 132.2
8 (C) 137.7
9 (CH2) 41.2
10 (CH2) 20.9
11 (CH) 44.8
12 (C) 75.8
13 (CH2) 41.3
14 (CH2) 28.7
15 (C) 37
16 (CH3) 25.9
17 (CH3) 28
18 (CH3) 24.3
19 (CH3) 16.4
20 (CH3) 16.4