(1aalpha,5abeta)-5beta-[(E)-1-Methylene-5-methyl-2,4-hexadienyl]-2aalpha,7aalpha-dimethyldecahydroazuleno[5,6-b]oxiren-2beta-ol

(1aalpha,5abeta)-5beta-[(E)-1-Methylene-5-methyl-2,4-hexadienyl]-2aalpha,7aalpha-dimethyldecahydroazuleno[5,6-b]oxiren-2beta-ol

Common Name: (1aalpha,5abeta)-5beta-[(E)-1-Methylene-5-methyl-2,4-hexadienyl]-2aalpha,7aalpha-dimethyldecahydroazuleno[5,6-b]oxiren-2beta-ol

Synonyms: (1aalpha,5abeta)-5beta-[(E)-1-Methylene-5-methyl-2,4-hexadienyl]-2aalpha,7aalpha-dimethyldecahydroazuleno[5,6-b]oxiren-2beta-ol

CAS Registry Number:

InChI: InChI=1S/C20H30O2/c1-13(2)7-6-8-14(3)15-9-11-19(4)16(15)10-12-20(5)18(22-20)17(19)21/h6-8,15-18,21H,3,9-12H2,1-2,4-5H3/b8-6+/t15-,16-,17+,18-,19-,20+/m0/s1

InChIKey: InChIKey=QEQBWVGEGRAMEW-HSUIOLILSA-N

Formula: C20H30O2

Molecular Weight: 302.45175

Exact Mass: 302.22458

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Shao, Y., Bai, N.S., Zhou, B.N. Phytochemistry (1996) 42, 783-6

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Sphenolobanes; 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) 23.9
2 (CH2) 34.7
3 (C) 62.3
4 (CH) 62.3
5 (CH) 69.3
6 (C) 48.3
7 (CH2) 35.4
8 (CH2) 28.3
9 (CH) 47.2
10 (CH) 45.1
11 (CH3) 23.9
12 (CH3) 16
13 (C) 149.6
14 (CH2) 111.9
15 (CH) 125.3
16 (CH) 125.7
17 (CH) 131.7
18 (C) 135.8
19 (CH3) 18.5
20 (CH3) 26.1