7a-H ydroxy-19-norabieta-8,11,13-triene-4-hydroperoxide

7a-H ydroxy-19-norabieta-8,11,13-triene-4-hydroperoxide

Common Name: 7a-H ydroxy-19-norabieta-8,11,13-triene-4-hydroperoxide

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C19H28O3/c1-12(2)13-6-7-15-14(10-13)16(20)11-17-18(15,3)8-5-9-19(17,4)22-21/h6-7,10,12,16-17,20-21H,5,8-9,11H2,1-4H3/t16-,17?,18-,19+/m1/s1

InChIKey: InChIKey=UABNYCNBLCAAST-MVCQKVDPSA-N

Formula: C19H28O3

Molecular Weight: 304.424538

Exact Mass: 304.203845

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Lee, C.K., Fang, J.M., Cheng, Y.S. Phytochemistry (1995) 39, 391-4

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) 38.1
2 (CH2) 18.3
3 (CH2) 34.7
4 (C) 84
5 (CH) 44.8
6 (CH2) 28.1
7 (CH) 68.3
8 (C) 135.7
9 (C) 146.4
10 (C) 37.6
11 (CH) 127.6
12 (CH) 126.6
13 (C) 146.5
14 (CH) 124.5
15 (CH) 33.5
16 (CH3) 23.8
17 (CH3) 24
19 (CH3) 24.8
20 (CH3) 24.4