11-Hydroxy-8,11,13-abietatriene 12-O-β-xylopyranose

11-Hydroxy-8,11,13-abietatriene 12-O-β-xylopyranose

Common Name: 11-Hydroxy-8,11,13-abietatriene 12-O-β-xylopyranose

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C25H38O6/c1-13(2)15-11-14-7-8-17-24(3,4)9-6-10-25(17,5)18(14)20(28)22(15)31-23-21(29)19(27)16(26)12-30-23/h11,13,16-17,19,21,23,26-29H,6-10,12H2,1-5H3/t16-,17+,19+,21-,23+,25+/m1/s1

InChIKey: InChIKey=HTEXSXCVDJMYMF-FTZXPEHCSA-N

Formula: C25H38O6

Molecular Weight: 434.566576

Exact Mass: 434.266839

NMR Solvent: CD3OD

MHz:

Calibration:

NMR references: 13C - Han, L., Huang, X., Dahse, H.M., Moellmann, U., Grabley, S., Lin, W., Sattler, I. Planta Med (2008) 74, 432-7

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) 37.8
2 (CH2) 20.4
3 (CH2) 42.9
4 (C) 34.7
5 (CH) 54.9
6 (CH2) 20.4
7 (CH2) 34
8 (C) 134.9
9 (C) 134.5
10 (C) 40.7
11 (C) 148.9
12 (C) 142.2
13 (C) 140.4
14 (CH) 117.7
15 (CH) 26.7
16 (CH3) 23.9
17 (CH3) 24.2
18 (CH3) 34.3
19 (CH3) 22.6
20 (CH3) 20
1' (CH) 108.5
2' (CH) 73
3' (CH) 74.6
4' (CH) 70.1
5' (CH2) 68.1