(5Z,8S,9E,11Z,14Z,17Z)-8-Hydroxy-5,9,11,14,17-Icosapentaenoic Acid
[CAS# 118492-81-2]

Identification

• Name: (5Z,8S,9E,11Z,14Z,17Z)-8-Hydroxy-5,9,11,14,17-Icosapentaenoic Acid
• Synonyms: "8S-hydroxy-5Z,9E,11Z,14Z,17Z-eicosapentaenoic acid"; (±)8-HEPE; 8(S)-HEPE
• Molecular Formula: C₂₀H₃₀O₃
• Molecular Weight: 318.45
• CAS Registry Number: 118492-81-2
• SMILES: O=C(O)CCC\C=C/C[C@H](O)\C=C\C=C/C\C=C/C\C=C/CC
• InChI: 1S/C20H30O3/c1-2-3-4-5-6-7-8-9-10-13-16-19(21)17-14-11-12-15-18-20(22)23/h3-4,6-7,9-11,13-14,16,19,21H,2,5,8,12,15,17-18H2,1H3,(H,22,23)/b4-3-,7-6-,10-9-,14-11-,16-13+/t19-/m1/s1
• InChIKey: WLOUCHKFBGGNEB-CHGUASJCSA-N

Properties

• Density: 0.997g/cm³ (Cal.)
• Boiling point: 475.222°C at 760 mmHg (Cal.)
• Flash point: 255.317°C (Cal.)
• Refractive index: 1.526 (Cal.)