13,14,15,16-Tetranorlabdane-8,12,18-triol

13,14,15,16-Tetranorlabdane-8,12,18-triol

Common Name: 13,14,15,16-Tetranorlabdane-8,12,18-triol

Synonyms: 13,14,15,16-Tetranorlabdane-8,12,18-triol

CAS Registry Number:

InChI: InChI=1S/C16H30O3/c1-14(11-18)7-4-8-15(2)12(14)5-9-16(3,19)13(15)6-10-17/h12-13,17-19H,4-11H2,1-3H3/t12-,13+,14-,15-,16+/m0/s1

InChIKey: InChIKey=OSLJXGPVHCLGHU-XFIYOXNOSA-N

Formula: C16H30O3

Molecular Weight: 270.408212

Exact Mass: 270.219495

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Hegazy, M.E.F., Ohta, S., Abdel-latif, F.F., Albadry, H.A., Ohta, E., Pare, P.W., Hirata, T. J Nat Prod (2008) 71, 1070-3

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Labdanes; 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) 38.9
2 (CH2) 17.8
3 (CH2) 35.2
4 (C) 37.7
5 (CH) 49
6 (CH2) 20.2
7 (CH2) 44
8 (C) 73
9 (CH) 59
10 (C) 38.9
11 (CH2) 27.9
12 (CH2) 64
17 (CH3) 24.6
18 (CH2) 71.8
19 (CH3) 17.4
20 (CH3) 15.7