Coronadiene

Coronadiene

Common Name: Coronadiene

Synonyms: Coronadiene

CAS Registry Number:

InChI: InChI=1S/C17H26O2/c1-12-6-8-14-16(2,3)10-5-11-17(14,4)13(12)7-9-15(18)19/h7,9,13-14H,1,5-6,8,10-11H2,2-4H3,(H,18,19)/b9-7+/t13-,14-,17+/m0/s1

InChIKey: InChIKey=GZRHZZSARAUGHK-VIJNKSRKSA-N

Formula: C17H26O2

Molecular Weight: 262.38778

Exact Mass: 262.19328

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Akiyama, K., Kikuzaki, H., Aoki, T., Okuda, A., Lajis, N.H., Nakatani, N. J Nat Prod (2006) 69, 1637-40

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) 40.8
2 (CH2) 19
3 (CH2) 42.1
4 (C) 33.5
5 (CH) 54.4
6 (CH2) 23.2
7 (CH2) 35.6
8 (C) 148.3
9 (CH) 60.6
10 (C) 39.3
11 (CH) 150.8
12 (CH) 122.7
13 (C) 169.6
17 (CH2) 108.8
18 (CH3) 33.6
19 (CH3) 21.9
20 (CH3) 15