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MTC 智能计算中心MTC Computing Center AI × 蛋白质与酶工程AI for Protein & Enzyme Engineering

化合物信息

名称 内容
kegg编号 C02166
pubchemid 5241
name Leukotriene C4
formula C30H47N3O9S
structure
Isomeric_Smiles CN(C)C=NC1=C(C=C(C(=C1I)CCC(=O)O)I)I
Cannoical_Smiles CN(C)C=NC1=C(C=C(C(=C1I)CCC(=O)O)I)I
Gotenzyme_Smiles CCCCC/C=C\C/C=C\C=C\C=C\[C@@H](SC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)NCC(=O)O)[C@@H](O)CCCC(=O)O