11-trans Leukotriene C4
[CAS# 74841-69-3]

Identification

• Name: 11-trans Leukotriene C4
• Synonyms: (5S,7E,9E,11E,14Z)-6-[(2R)-2-Amino-3-[[(4S)-4-Amino-5-Hydroxy-5-Oxo-Pentanoyl]-(Carboxymethyl)Amino]-3-Oxo-Propyl]Sulfanyl-5-Hydroxy-Icosa-7,9,11,14-Tetraenoic Acid; (5S,7E,9E,11E,14Z)-6-[[(2R)-2-Amino-3-[[(4S)-4-Amino-5-Hydroxy-1,5-Dioxopentyl]-(Carboxymethyl)Amino]-3-Oxopropyl]Thio]-5-Hydroxyicosa-7,9,11,14-Tetraenoic Acid; (5S,7E,9E,11E,14Z)-6-[[(2R)-2-Amino-3-[[(4S)-4-Amino-5-Hydroxy-5-Keto-Pentanoyl]-(Carboxymethyl)Amino]-3-Keto-Propyl]Thio]-5-Hydroxy-Icosa-7,9,11,14-Tetraenoic Acid
• Molecular Formula: C₃₀H₄₇N₃O₉S
• Molecular Weight: 625.78
• CAS Registry Number: 74841-69-3
• SMILES: [C@@H](N)(C(=O)N(C(=O)CC[C@H](N)C(=O)O)CC(=O)O)CSC([C@@H](O)CCCC(=O)O)\C=C\C=C\C=C\C\C=C/CCCCC
• InChI: 1S/C30H47N3O9S/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-25(24(34)15-14-17-27(36)37)43-21-23(32)29(40)33(20-28(38)39)26(35)19-18-22(31)30(41)42/h6-7,9-13,16,22-25,34H,2-5,8,14-15,17-21,31-32H2,1H3,(H,36,37)(H,38,39)(H,41,42)/b7-6-,10-9+,12-11+,16-13+/t22-,23-,24-,25?/m0/s1
• InChIKey: KVSDCBWIPGWMGL-IQFOYCAVSA-N