1abeta,5,6,7,7aalpha,7bbeta-Hexahydro-1-(hydroxymethyl)-1alpha,4,7beta-trimethyl-1H-cyclopropa[e]azulene-3(2H)-one

1abeta,5,6,7,7aalpha,7bbeta-Hexahydro-1-(hydroxymethyl)-1alpha,4,7beta-trimethyl-1H-cyclopropa[e]azulene-3(2H)-one

Common Name: 1abeta,5,6,7,7aalpha,7bbeta-Hexahydro-1-(hydroxymethyl)-1alpha,4,7beta-trimethyl-1H-cyclopropa[e]azulene-3(2H)-one

Synonyms: 1abeta,5,6,7,7aalpha,7bbeta-Hexahydro-1-(hydroxymethyl)-1alpha,4,7beta-trimethyl-1H-cyclopropa[e]azulene-3(2H)-one

CAS Registry Number:

InChI: InChI=1S/C15H22O2/c1-8-4-5-10-9(2)12(17)6-11-14(13(8)10)15(11,3)7-16/h8,11,13-14,16H,4-7H2,1-3H3/t8-,11-,13-,14-,15+/m1/s1

InChIKey: InChIKey=FFODVFHYFVHCLI-GNWSSZPXSA-N

Formula: C15H22O2

Molecular Weight: 234.334545

Exact Mass: 234.16198

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Staerk, D., Skole, B., Jorgensen, F.S., Budnik, B.A., Ekpe, P., Jaroszewski, J.W. J Nat Prod (2004) 67, 799-805

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Aromadendranes; 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) 165.3
2 (CH2) 34
3 (CH2) 32.3
4 (CH) 37.4
5 (CH) 44.2
6 (CH) 27.8
7 (CH) 19.7
8 (CH2) 41.3
9 (C) 200.3
10 (C) 130.6
11 (C) 31.4
12 (CH3) 11.8
13 (CH2) 72.2
14 (CH3) 15
15 (CH3) 15.5