Leukotriene C3
[CAS# 77209-77-9]

Identification

• Name: Leukotriene C3
• Synonyms: (5S,7E,9E,11E)-6-[(2R)-2-[[(4S)-4-Amino-5-Hydroxy-5-Oxo-Pentanoyl]Amino]-3-(Carboxymethylamino)-3-Oxo-Propyl]Sulfanyl-5-Hydroxy-Icosa-7,9,11-Trienoic Acid; (5S,7E,9E,11E)-6-[[(2R)-2-[[(4S)-4-Amino-5-Hydroxy-1,5-Dioxopentyl]Amino]-3-(Carboxymethylamino)-3-Oxopropyl]Thio]-5-Hydroxyicosa-7,9,11-Trienoic Acid; 2-[[(2R)-2-[[(4S)-4-Amino-5-Hydroxy-5-Keto-Pentanoyl]Amino]-3-[[(2E,4E,6E)-1-[(1S)-1,5-Dihydroxy-5-Keto-Pentyl]Pentadeca-2,4,6-Trienyl]Thio]Propanoyl]Amino]Acetic Acid
• Molecular Formula: C₃₀H₄₉N₃O₉S
• Molecular Weight: 627.79
• CAS Registry Number: 77209-77-9
• SMILES: [C@@H](NC(=O)CC[C@H](N)C(=O)O)(C(=O)NCC(=O)O)CSC([C@@H](O)CCCC(=O)O)\C=C\C=C\C=C\CCCCCCCC
• InChI: 1S/C30H49N3O9S/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(29(40)32-20-28(38)39)33-26(35)19-18-22(31)30(41)42/h9-13,16,22-25,34H,2-8,14-15,17-21,31H2,1H3,(H,32,40)(H,33,35)(H,36,37)(H,38,39)(H,41,42)/b10-9+,12-11+,16-13+/t22-,23-,24-,25?/m0/s1
• InChIKey: AIJDQMYBRDJHHT-SJYCEDLTSA-N