Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H34O3/c1-6-18(3)11-8-15-19(4)10-7-9-17(2,13-21)16(19)14(22)12-20(15,5)23-18/h6,14-16,21-22H,1,7-13H2,2-5H3/t14-,15+,16-,17-,18-,19+,20+/m1/s1
InChIKey: InChIKey=SWTFEMNRTPYRNV-IRIQXGSBSA-N
Formula: C20H34O3
Molecular Weight: 322.482918
Exact Mass: 322.250795
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Garcia-Granados, A., Gutierrez, J.J., Martinez, A., Rivas, F., Arias, J.M. Phytochemistry (1997) 45, 283-91
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) | 38.7 |
2 (CH2) | 17.9 |
3 (CH2) | 38.3 |
4 (C) | 37.6 |
5 (CH) | 57.4 |
6 (CH) | 67.2 |
7 (CH2) | 53.4 |
8 (C) | 73.6 |
9 (CH) | 54.2 |
10 (C) | 38.2 |
11 (CH2) | 15.5 |
12 (CH2) | 35 |
13 (C) | 74.7 |
14 (CH) | 147.5 |
15 (CH2) | 110.7 |
16 (CH3) | 28.9 |
17 (CH3) | 26.9 |
18 (CH2) | 74.8 |
19 (CH3) | 17.7 |
20 (CH3) | 16.8 |