8-Hydroxy-alpha-guaiene

8-Hydroxy-alpha-guaiene

Common Name: 8-Hydroxy-alpha-guaiene

Synonyms: 8-Hydroxy-alpha-guaiene

CAS Registry Number:

InChI: InChI=1S/C15H24O/c1-9(2)13-8-14-10(3)5-6-12(14)11(4)7-15(13)16/h10-11,13,15-16H,1,5-8H2,2-4H3/t10-,11-,13+,15+/m0/s1

InChIKey: InChIKey=BRFKQPRYMGBIFJ-HTTKSJEASA-N

Formula: C15H24O1

Molecular Weight: 220.351021

Exact Mass: 220.182715

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Kanlayavattanakul, M., Ruangrungsi, N., Watanabe, T., Kawahata, M., Therrien, B., Yamaguchi, K., Ishikawa, T. J Nat Prod (2005) 68, 7-10

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Guaianes; 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 (C) 139.6
2 (CH2) 33.8
3 (CH2) 30.8
4 (CH) 46.1
5 (C) 140.9
6 (CH2) 26
7 (CH) 49.7
8 (CH) 68.3
9 (CH2) 42
10 (CH) 29.2
11 (C) 148
12 (CH2) 112.3
13 (CH3) 23
14 (CH3) 20
15 (CH3) 21.6