2-[[(R)-3,6-Dihydro-5-[(1S)-3alpha-(1-methylethenyl)-4beta-vinyl-4-methylcyclohexyl]-2H-pyran]-2beta-yl]propan-2-ol acetate

2-[[(R)-3,6-Dihydro-5-[(1S)-3alpha-(1-methylethenyl)-4beta-vinyl-4-methylcyclohexyl]-2H-pyran]-2beta-yl]propan-2-ol acetate

Common Name: 2-[[(R)-3,6-Dihydro-5-[(1S)-3alpha-(1-methylethenyl)-4beta-vinyl-4-methylcyclohexyl]-2H-pyran]-2beta-yl]propan-2-ol acetate

Synonyms: 2-[[(R)-3,6-Dihydro-5-[(1S)-3alpha-(1-methylethenyl)-4beta-vinyl-4-methylcyclohexyl]-2H-pyran]-2beta-yl]propan-2-ol acetate

CAS Registry Number:

InChI: InChI=1S/C22H34O3/c1-8-22(7)12-11-17(13-19(22)15(2)3)18-9-10-20(24-14-18)21(5,6)25-16(4)23/h8-9,17,19-20H,1-2,10-14H2,3-7H3/t17-,19+,20+,22-/m0/s1

InChIKey: InChIKey=ASFMVDIIZYGBKO-RYTRXMBJSA-N

Formula: C22H34O3

Molecular Weight: 346.50439

Exact Mass: 346.250795

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Edrada, R.A., Proksch, P., Wray, V., Witte, L., van Ofwegen, L. J Nat Prod (1998) 61, 358-61

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Lobanes; 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) 39.7
2 (CH) 52.8
3 (CH2) 32.8
4 (CH) 41.7
5 (CH2) 25
6 (CH2) 39.9
7 (CH3) 16.6
8 (CH) 150.1
9 (CH2) 112.3
10 (C) 147.5
11 (CH2) 110
12 (CH3) 24.8
13 (C) 141.4
14 (CH2) 68.4
15 (CH) 116.3
16 (CH2) 27.1
17 (CH) 78.3
18 (C) 83.1
19 (CH3) 22.5
20 (CH3) 22.6
18a (C) 170.6
18b (CH3) 21.7