Common Name: (2E,6Z,10E,12R)-7-(Acetoxymethyl)-3,11,15-trimethyl-12-hydroxy-2,6,10,14-hexadecatetraenal
Synonyms: (2E,6Z,10E,12R)-7-(Acetoxymethyl)-3,11,15-trimethyl-12-hydroxy-2,6,10,14-hexadecatetraenal
CAS Registry Number:
InChI: InChI=1S/C22H34O4/c1-17(2)12-13-22(25)19(4)9-7-11-21(16-26-20(5)24)10-6-8-18(3)14-15-23/h9-10,12,14-15,22,25H,6-8,11,13,16H2,1-5H3/b18-14+,19-9+,21-10-/t22-/m1/s1
InChIKey: InChIKey=ZOXDAANNUDSSLU-ORMYALOKSA-N
Formula: C22H34O4
Molecular Weight: 362.503795
Exact Mass: 362.24571
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Gao, X., Zhang, Z.X., Jia, Z.J. Helv Chim Acta (2008) 91, 1934-9
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Phytanes; 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 (CH) | 191.4 |
2 (CH) | 127.8 |
3 (C) | 163 |
4 (CH2) | 40.6 |
5 (CH2) | 26.1 |
6 (CH) | 129.1 |
7 (C) | 135.2 |
8 (CH2) | 35.1 |
9 (CH2) | 25.5 |
10 (CH) | 125.3 |
11 (C) | 137.6 |
12 (CH) | 77.2 |
13 (CH2) | 34.5 |
14 (CH) | 120.4 |
15 (C) | 134.7 |
16 (CH3) | 25.5 |
17 (CH3) | 18.2 |
18 (CH3) | 12 |
19 (CH2) | 61.8 |
20 (CH3) | 17.7 |
19a (C) | 171.2 |
19b (CH3) | 21.1 |