Leukotriene D4
[CAS# 73836-78-9]

Identification

• Name: Leukotriene D4
• Synonyms: (5S,6R,7E,9E,11Z,14Z)-6-[2-Amino-3-(Carboxymethylamino)-3-Oxo-Propyl]Sulfanyl-5-Hydroxy-Icosa-7,9,11,14-Tetraenoic Acid; (5S,6R,7E,9E,11Z,14Z)-6-[[2-Amino-3-(Carboxymethylamino)-3-Oxopropyl]Thio]-5-Hydroxyicosa-7,9,11,14-Tetraenoic Acid; 2-[[2-Amino-3-[[(1R,2E,4E,6Z,9Z)-1-[(1S)-1,5-Dihydroxy-5-Keto-Pentyl]Pentadeca-2,4,6,9-Tetraenyl]Thio]Propanoyl]Amino]Acetic Acid
• Molecular Formula: C₂₅H₄₀N₂O₆S
• Molecular Weight: 496.66
• CAS Registry Number: 73836-78-9
• SMILES: [C@H](SCC(N)C(=O)NCC(=O)O)([C@@H](O)CCCC(=O)O)\C=C\C=C\C=C/C/C=C\CCCCC
• InChI: 1S/C25H40N2O6S/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-22(21(28)15-14-17-23(29)30)34-19-20(26)25(33)27-18-24(31)32/h6-7,9-13,16,20-22,28H,2-5,8,14-15,17-19,26H2,1H3,(H,27,33)(H,29,30)(H,31,32)/b7-6-,10-9-,12-11+,16-13+/t20?,21-,22+/m0/s1
• InChIKey: YEESKJGWJFYOOK-LDDGIIIKSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 785.8±60.0°C at 760 mmHg (Cal.)
• Flash point: 429.0±32.9°C (Cal.)