4,15-Dihydroxy-19-norabieta-8,11,13-triene-7-one

4,15-Dihydroxy-19-norabieta-8,11,13-triene-7-one

Common Name: 4,15-Dihydroxy-19-norabieta-8,11,13-triene-7-one

Synonyms: 4,15-Dihydroxy-19-norabieta-8,11,13-triene-7-one

CAS Registry Number:

InChI: InChI=1S/C19H26O3/c1-17(2,21)12-6-7-14-13(10-12)15(20)11-16-18(14,3)8-5-9-19(16,4)22/h6-7,10,16,21-22H,5,8-9,11H2,1-4H3/t16-,18-,19+/m1/s1

InChIKey: InChIKey=SGCHZBKQDFNHSL-QRQLOZEOSA-N

Formula: C19H26O3

Molecular Weight: 302.408656

Exact Mass: 302.188195

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Kuo, Y.H., Yeh, M.H. Phytochemistry (1998) 49, 2453-5

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) 37.1
2 (CH2) 18
3 (CH2) 40.7
4 (C) 71.4
5 (CH) 47.9
6 (CH2) 35.3
7 (C) 199.4
8 (C) 130.7
9 (C) 153.8
10 (C) 37.5
11 (CH) 123.6
12 (CH) 130.4
13 (C) 147
14 (CH) 123.1
15 (C) 72.3
16 (CH3) 31.3
17 (CH3) 31.6
18 (CH3) 30.1
20 (CH3) 23.8