(+/-)5(6)-DIHETE
9780
Reference
(+/-)5(6)-DIHETE Structure
Systematic / IUPAC Name: (5S,6R,8Z,11Z,14Z,17Z)-5,6-Dihydroxyicosa-8,11,14,17-tetraenoic acid
ID: Reference9780
Other Names:
8,11,14,17-Eicosatetraenoic acid, 5,6-dihydroxy-, (5S,6R,8Z,11Z,14Z,17Z)-;
(+/-)5,6-Dihydroxy-8Z,11Z,14Z,17Z-eicosatetraenoic acid
Formula: C20H32O4
Class: Endogenous Metabolites
Spectral Data
(+/-)5(6)-DIHETE mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion with FAIMS |
| No. of Spectral Trees | 1 |
| No. of Spectra | 864 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 6/18/2020 10:52:54 AM |
Identificators
| InChI | InChI=1S/C20H32O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18(21)19(22)16-14-17-20(23)24/h3-4,6-7,9-10,12-13,18-19,21-22H,2,5,8,11,14-17H2,1H3,(H,23,24)/b4-3-,7-6-,10-9-,13-12-/t18-,19+/m1/s1 |
| InChI Key | VPXVODYVPILPRC-CLQAUIESSA-N |
| Canonical SMILES | CCC=CCC=CCC=CCC=CCC(C(CCCC(=O)O)O)O |
| CAS | 845673974 |
| Splash | |
| Other Names |
8,11,14,17-Eicosatetraenoic acid, 5,6-dihydroxy-, (5S,6R,8Z,11Z,14Z,17Z)-; (+/-)5,6-Dihydroxy-8Z,11Z,14Z,17Z-eicosatetraenoic acid |