20-hydroxy Leukotriene B4
9857
Reference
20-hydroxy Leukotriene B4 Structure
Systematic / IUPAC Name: (5S,6Z,8E,10E,12R,14Z)-5,12,20-Trihydroxy-6,8,10,14-icosatetraenoic acid
ID: Reference9857
Other Names:
20-OH-LTB4;
5,12,20-THETE;
5,12,20-TRIHETE;
(5R,12S,6Z,8E,10E,14Z)-5,12,20-Trihydroxy-6,8,10,14-icosatetraenoic acid;
(5S,12R)-5,12,20-Trihydroxy-(6Z,8E,10E,14Z)-eicosatetraenoate
; more
Formula: C20H32O5
Class: Endogenous Metabolites
Spectral Data
20-hydroxy Leukotriene B4 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 | 990 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 7/30/2020 7:27:54 AM |
Identificators
| InChI | InChI=1S/C20H32O5/c21-17-10-6-2-1-3-7-12-18(22)13-8-4-5-9-14-19(23)15-11-16-20(24)25/h3-5,7-9,13-14,18-19,21-23H,1-2,6,10-12,15-17H2,(H,24,25)/b5-4+,7-3-,13-8+,14-9-/t18-,19-/m1/s1 |
| InChI Key | PTJFJXLGRSTECQ-PSPARDEHSA-N |
| Canonical SMILES | C(CCC=CCC(C=CC=CC=CC(CCCC(=O)O)O)O)CCO |
| CAS | 79516828 |
| Splash | |
| Other Names |
20-OH-LTB4; 5,12,20-THETE; 5,12,20-TRIHETE; (5R,12S,6Z,8E,10E,14Z)-5,12,20-Trihydroxy-6,8,10,14-icosatetraenoic acid; (5S,12R)-5,12,20-Trihydroxy-(6Z,8E,10E,14Z)-eicosatetraenoate; (5S,12R)-5,12,20-Trihydroxy-(6Z,8E,10E,14Z)-eicosatetraenoic acid; (5S,6Z,8E,10E,12R,14Z)-5,12,20-Trihydroxyicosa-6,8,10,14-tetraenoic acid; (6Z,8E,10E,14Z)-(5S,12R)-5,12,20-Trihydroxyeicosa-6,8,10,14-tetraenoate; (6Z,8E,10E,14Z)-(5S,12R)-5,12,20-Trihydroxyeicosa-6,8,10,14-tetraenoic acid; (6Z,8E,10E,14Z)-(5S,12R)-5,12,20-Trihydroxyicosa-6,8,10,14-tetraenoate; (6Z,8E,10E,14Z)-(5S,12R)-5,12,20-Trihydroxyicosa-6,8,10,14-tetraenoic acid; [S-[R*,S*-(E,Z,E,Z)]]-5,12,20-Trihydroxy-6,8,10,14-eicosatetraenoate; [S-[R*,S*-(E,Z,E,Z)]]-5,12,20-Trihydroxy-6,8,10,14-eicosatetraenoic acid; 20-Hydroxy leukotriene B4; 20-Hydroxy LTB4; 20-OH-5S,12S-Dihydroxy-6,10-trans-8,14-cis-eicosatetraenoate; 20-OH-5S,12S-Dihydroxy-6,10-trans-8,14-cis-eicosatetraenoic acid; 5S,12R,20-Trihydroxy-6Z,8E,10E,14Z-eicosatetraenoate; 5S,12R,20-Trihydroxy-6Z,8E,10E,14Z-eicosatetraenoic acid; 6,8,10,14-Eicosatetraenoic acid, 5,12,20-trihydroxy-, (5S,6Z,8E,10E,12R,14Z)-; LTB4-20-hydroxy; ω-Hydroxy-LTB4; w-Hydroxy-LTB4 |
In Other Databases
| HMDb | HMDB0001509 |
| PubChem | 5280745 |
| KEGG | C04853 |
| ChEBI | CHEBI:15646 |
| ChemSpider | 4444320 |
| ChEMBL | CHEMBL1593789 |