Compound Details

 Compound-ID 6045
 Common Name Leukotriene C4
 InChI 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(29(40)32-20-28(38)39)33-26(35)19-18-22(31)30(41)42/h6-7,9-13,16,22-25,34H,2-5,8,14-15,17-21,31H2,1H3,(H,32,40)(H,33,35)(H,36,37)(H,38,39)(H,41,42)/b7-6-,10-9-,12-11+,16-13+/t22-,23-,24-,25+/m0/s1
 SMILES CCCCCC=CCC=CC=CC=CC(C(O)CCCC(O)=O)SCC(NC(=O)CCC(N)C(O)=O)C(=O)NCC(O)=O
 External Links
 KEGG-COMPOUND-ID C02166
 PUBCHEM-ID 5241
 ChEBI-ID 16978
 REACTOME-ID 266066
 METACYC-ID LEUKOTRIENE-C4
 METANETX-ID MNXM734251
 BioModels 16978


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