(1R)-1-Methyl-4beta-isopropyl-6-(acetoxymethyl)-1,2,3,4,4abeta,7,8,8aalpha-octahydronaphthalene-1alpha-ol

(1R)-1-Methyl-4beta-isopropyl-6-(acetoxymethyl)-1,2,3,4,4abeta,7,8,8aalpha-octahydronaphthalene-1alpha-ol

Common Name: (1R)-1-Methyl-4beta-isopropyl-6-(acetoxymethyl)-1,2,3,4,4abeta,7,8,8aalpha-octahydronaphthalene-1alpha-ol

Synonyms: (1R)-1-Methyl-4beta-isopropyl-6-(acetoxymethyl)-1,2,3,4,4abeta,7,8,8aalpha-octahydronaphthalene-1alpha-ol

CAS Registry Number:

InChI: InChI=1S/C17H28O3/c1-11(2)14-7-8-17(4,19)16-6-5-13(9-15(14)16)10-20-12(3)18/h9,11,14-16,19H,5-8,10H2,1-4H3/t14-,15-,16+,17+/m0/s1

InChIKey: InChIKey=XLTDPRQIEUARTG-MWDXBVQZSA-N

Formula: C17H28O3

Molecular Weight: 280.403066

Exact Mass: 280.203845

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Kuo, Y.H., Chen, C.H., Chien, S.C., Lin, Y.L. J Nat Prod (2002) 65, 25-8

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Cadinanes; 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) 49.7
2 (CH2) 22.1
3 (CH2) 26.7
4 (C) 133.7
5 (CH) 127.4
6 (CH) 39.8
7 (CH) 46.2
8 (CH2) 22
9 (CH2) 42.1
10 (C) 72.3
11 (CH) 26
12 (CH3) 15.1
13 (CH3) 21.4
14 (CH2) 68.8
15 (CH3) 20.7
14a (C) 171
14b (CH3) 21