(4Z,7Z,10Z,13Z,17Z,19Z)-16-Hydroxy-4,7,10,13,17,19-docosahexaenoic acid
[CAS# 90780-51-1]

Identification

• Name: (4Z,7Z,10Z,13Z,17Z,19Z)-16-Hydroxy-4,7,10,13,17,19-docosahexaenoic acid
• Synonyms: "(±)16-hydroxy-4Z,7Z,10Z,13Z,17E,19Z-docosahexaenoic acid"; (±)16-HDoHE; (ñ)16-HDoHE
• Molecular Formula: C₂₂H₃₂O₃
• Molecular Weight: 344.49
• CAS Registry Number: 90780-51-1
• SMILES: CCC=CC=CC(CC=CCC=CCC=CCC=CCCC(=O)O)O
• InChI: 1S/C22H32O3/c1-2-3-4-15-18-21(23)19-16-13-11-9-7-5-6-8-10-12-14-17-20-22(24)25/h3-4,6-9,12-16,18,21,23H,2,5,10-11,17,19-20H2,1H3,(H,24,25)/b4-3-,8-6-,9-7-,14-12-,16-13-,18-15-
• InChIKey: CSXQXWHAGLIFIH-OMFYHICESA-N

Properties

• Density: 0.996g/cm³ (Cal.)
• Boiling point: 511.23°C at 760 mmHg (Cal.)
• Flash point: 277.069°C (Cal.)