Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C21H36O4/c1-13(2)18(22)9-6-14(3)17-8-7-15(4)21(17)11-10-16(19(23)12-21)20(24)25-5/h10,13-15,17-19,22-23H,6-9,11-12H2,1-5H3/t14-,15+,17?,18-,19+,21+/m1/s1
InChIKey: InChIKey=XPCAEPWERCDOLA-COKPZBFESA-N
Formula: C21H36O4
Molecular Weight: 352.508941
Exact Mass: 352.26136
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Foster, P.G., Ghisalberti, E.L., Jefferies, P.R. Aust J Chem (1986) 39, 2111
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Viscidanes; 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 (C) | 46.9 |
2 (CH2) | 37.6 |
3 (CH) | 65 |
4 (C) | 132.5 |
5 (CH) | 142 |
6 (CH2) | 31.4 |
7 (CH) | 40 |
8 (CH2) | 29.8 |
9 (CH2) | 26.4 |
10 (CH) | 50.2 |
11 (CH) | 33.7 |
12 (CH2) | 31.9 |
13 (CH2) | 31.4 |
14 (CH) | 76.8 |
15 (CH) | 34 |
16 (CH3) | 19 |
17 (CH3) | 17.3 |
18 (CH3) | 20.1 |
19 (CH3) | 17.3 |
20 (C) | 167.8 |
20a (CH3) | 51.7 |