18-Norabieta-8,11,13-triene-4,7alpha-diol

18-Norabieta-8,11,13-triene-4,7alpha-diol

Common Name: 18-Norabieta-8,11,13-triene-4,7alpha-diol

Synonyms: 18-Norabieta-8,11,13-triene-4,7alpha-diol

CAS Registry Number:

InChI: InChI=1S/C19H28O2/c1-12(2)13-6-7-15-14(10-13)16(20)11-17-18(15,3)8-5-9-19(17,4)21/h6-7,10,12,16-17,20-21H,5,8-9,11H2,1-4H3/t16-,17-,18-,19-/m1/s1

InChIKey: InChIKey=PIJPSWNOKIPSCP-NCXUSEDFSA-N

Formula: C19H28O2

Molecular Weight: 288.425133

Exact Mass: 288.20893

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Ohtsu, H., Tanaka, R., Matsunaga, S. J Nat Prod (1998) 61, 406-8

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Abietanes; 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) 37.7
2 (CH2) 20.5
3 (CH2) 42.6
4 (C) 71.8
5 (CH) 46.3
6 (CH2) 27.1
7 (CH) 68.1
8 (C) 135.9
9 (C) 146.4
10 (C) 38.7
11 (CH) 124.7
12 (CH) 126.6
13 (C) 146.5
14 (CH) 128.1
15 (CH) 33.5
16 (CH3) 23.9
17 (CH3) 24
19 (CH3) 22.5
20 (CH3) 23.5