(+/-)5(6)-DiHET
9790
Reference
(+/-)5(6)-DiHET Structure
Systematic / IUPAC Name: (5S,6R,8Z,11Z,14Z)-5,6-Dihydroxy-8,11,14-icosatrienoic acid
ID: Reference9790
Other Names: (+/-)5,6-DiHETrE
Formula: C20H34O4
Class: Endogenous Metabolites
Spectral Data
(+/-)5(6)-DiHET 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 | 2 |
| No. of Spectra | 750 |
| Tandem Spectra | MS1, MS2, MS3 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 6/25/2020 12:55:14 PM |
Identificators
| InChI | InChI=1S/C20H34O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18(21)19(22)16-14-17-20(23)24/h6-7,9-10,12-13,18-19,21-22H,2-5,8,11,14-17H2,1H3,(H,23,24)/b7-6-,10-9-,13-12-/t18-,19+/m1/s1 |
| InChI Key | GFNYAPAJUNPMGH-GSKBNKFLSA-N |
| Canonical SMILES | CCCCCC=CCC=CCC=CCC(C(CCCC(=O)O)O)O |
| CAS | 213382491 |
| Splash | |
| Other Names | (+/-)5,6-DiHETrE |