(5E,7Z,10Z,13Z,16Z,19Z)-4-Hydroxydocosa-5,7,10,13,16,19-hexaenoic Acid - CAS 90906-40-4
Catalog: |
BB039985 |
Product Name: |
(5E,7Z,10Z,13Z,16Z,19Z)-4-Hydroxydocosa-5,7,10,13,16,19-hexaenoic Acid |
CAS: |
90906-40-4 |
Synonyms: |
4-hydroxydocosa-5,7,10,13,16,19-hexaenoic acid; 4-hydroxydocosa-5,7,10,13,16,19-hexaenoic acid |
IUPAC Name: | 4-hydroxydocosa-5,7,10,13,16,19-hexaenoic acid |
Description: | (5E,7Z,10Z,13Z,16Z,19Z)-4-Hydroxydocosa-5,7,10,13,16,19-hexaenoic Acid (CAS# 90906-40-4 ) is a useful research chemical. |
Molecular Weight: | 344.49 |
Molecular Formula: | C22H32O3 |
Canonical SMILES: | CCC=CCC=CCC=CCC=CCC=CC=CC(CCC(=O)O)O |
InChI: | InChI=1S/C22H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21(23)19-20-22(24)25/h3-4,6-7,9-10,12-13,15-18,21,23H,2,5,8,11,14,19-20H2,1H3,(H,24,25) |
InChI Key: | IFRKCNPQVIJFAQ-UHFFFAOYSA-N |
LogP: | 5.51970 |
Publication Number | Title | Priority Date |
EP-2858496-A2 | Oils with anti-inflammatory activity containing natural specialized proresolving mediators and their precursors | 20120510 |
US-2015126602-A1 | Oils with anti-inflammatory activity containing natural specialized proresolving mediators and their precursors | 20120510 |
WO-2013170006-A2 | Oils with anti-inflammatory activity containing natural specialized proresolving mediators and their precursors | 20120510 |
US-2013274327-A1 | Novel anti-inflammatory metabolite derived from omega-3-type fatty acid | 20100819 |
WO-2011131619-A1 | Method of synthesizing a 5-oxo-conjugated fatty acid | 20100421 |
PMID | Publication Date | Title | Journal |
12963475 | 20030915 | Lactonase and lactonizing activities of human serum paraoxonase (PON1) and rabbit serum PON3 | Biochemical pharmacology |
Complexity: | 493 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 344.23514488 |
Formal Charge: | 0 |
Heavy Atom Count: | 25 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 344.23514488 |
Rotatable Bond Count: | 14 |
Topological Polar Surface Area: | 57.5 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 6 |
XLogP3: | 5.1 |
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