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)
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 |