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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 C12216
pubchemid 14361
name Mycobactin S
formula C44H69N5O10
structure
Isomeric_Smiles C1=CC=C(C=C1)[Hg].C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)O
Cannoical_Smiles C1=CC=C(C=C1)[Hg].C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)O
Gotenzyme_Smiles CCCCCCCCCCCCCCC/C=C/C(=O)N(O)CCCCC(NC(=O)C1COC(c2ccccc2O)=N1)C(=O)OC(C)CC(=O)NC1CCCCN(O)C1=O