(4S)-3,4abeta,5beta-Trimethyl-4beta-acetoxy-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-b]furan-8abeta-ol

(4S)-3,4abeta,5beta-Trimethyl-4beta-acetoxy-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-b]furan-8abeta-ol

Common Name: (4S)-3,4abeta,5beta-Trimethyl-4beta-acetoxy-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-b]furan-8abeta-ol

Synonyms: (4S)-3,4abeta,5beta-Trimethyl-4beta-acetoxy-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-b]furan-8abeta-ol

CAS Registry Number:

InChI: InChI=1S/C17H24O4/c1-10-9-20-13-8-17(19)7-5-6-11(2)16(17,4)15(14(10)13)21-12(3)18/h9,11,15,19H,5-8H2,1-4H3/t11-,15+,16-,17-/m0/s1

InChIKey: InChIKey=TVNQHBGTXBVVIR-FKSAFCJBSA-N

Formula: C17H24O4

Molecular Weight: 292.370708

Exact Mass: 292.167459

NMR Solvent: C6D6

MHz:

Calibration:

NMR references: 13C - Tori, M., Watanabe, A., Matsuo, S., Okamoto, Y., Tachikawa, K., Takaoka, S., Gong, X., Kuroda, C., Hanai, R. Tetrahedron (2008) 64, 4486-95

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eremophilanes; 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) 33.5
2 (CH2) 22.3
3 (CH2) 29.2
4 (CH) 33.8
5 (C) 45.5
6 (CH) 70.5
7 (C) 115.6
8 (C) 151.9
9 (CH2) 34.1
10 (C) 75
11 (C) 119.6
12 (CH) 139.1
13 (CH3) 8.2
14 (CH3) 10
15 (CH3) 16.1
6a (C) 169.5
6b (CH3) 20.2