(4Z,7E,9E,13Z,16Z,19Z)-11-Hydroxy-4,7,9,13,16,19-docosahexaenoic acid
[CAS# 87018-59-5]

Identification

• Name: (4Z,7E,9E,13Z,16Z,19Z)-11-Hydroxy-4,7,9,13,16,19-docosahexaenoic acid
• Synonyms: "(±)11-hydroxy-4Z,7Z,9E,13Z,16Z,19Z-docosahexaenoic acid"; (±)11-HDoHE; (ñ)11-HDoHE
• Molecular Formula: C₂₂H₃₂O₃
• Molecular Weight: 344.49
• CAS Registry Number: 87018-59-5
• SMILES: CCC=CCC=CCC=CCC(C=CC=CCC=CCCC(=O)O)O
• InChI: 1S/C22H32O3/c1-2-3-4-5-6-7-9-12-15-18-21(23)19-16-13-10-8-11-14-17-20-22(24)25/h3-4,6-7,10-16,19,21,23H,2,5,8-9,17-18,20H2,1H3,(H,24,25)/b4-3-,7-6-,13-10+,14-11-,15-12-,19-16+
• InChIKey: LTERDCBCHFKFRI-KEFMQFBKSA-N

Properties

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