1,2,3,3aalpha,4,5,5a,8,9,10,10aalpha,10b-Dodecahydro-5abeta,8,10bbeta-trimethyl-3beta-isopropenylcyclohepta[e]indene-8beta-ol

1,2,3,3aalpha,4,5,5a,8,9,10,10aalpha,10b-Dodecahydro-5abeta,8,10bbeta-trimethyl-3beta-isopropenylcyclohepta[e]indene-8beta-ol

Common Name: 1,2,3,3aalpha,4,5,5a,8,9,10,10aalpha,10b-Dodecahydro-5abeta,8,10bbeta-trimethyl-3beta-isopropenylcyclohepta[e]indene-8beta-ol

Synonyms: 1,2,3,3aalpha,4,5,5a,8,9,10,10aalpha,10b-Dodecahydro-5abeta,8,10bbeta-trimethyl-3beta-isopropenylcyclohepta[e]indene-8beta-ol

CAS Registry Number:

InChI: InChI=1S/C20H32O/c1-14(2)15-6-11-20(5)16(15)7-9-18(3)12-13-19(4,21)10-8-17(18)20/h12-13,15-17,21H,1,6-11H2,2-5H3/t15-,16+,17+,18+,19-,20+/m0/s1

InChIKey: InChIKey=RKCZDGJPJJXXLC-GPBSYSOESA-N

Formula: C20H32O1

Molecular Weight: 288.468227

Exact Mass: 288.245316

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Urones, J.G., Marcos, I.S., Basabe, P., Alonso, C., Oliva, I.M., Garrido, N.M., Martin, D.D., Lithgow, A.M. Tetrahedron (1993) 34, 4051-62

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Valparanes; 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) 133.5
2 (CH) 142.4
3 (C) 73.6
4 (CH2) 43.2
5 (CH2) 23.7
6 (CH) 57.7
7 (C) 46.9
8 (CH) 54.8
9 (CH2) 21.6
10 (CH2) 45.1
11 (C) 40.4
12 (CH2) 41.7
13 (CH2) 27.2
14 (CH) 46.4
15 (C) 148.4
16 (CH2) 110.3
17 (CH3) 24.9
18 (CH3) 16.2
19 (CH3) 30.1
20 (CH3) 21.7