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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 C19158
pubchemid 124489830
name Bis(chloromethyl) ether
formula C2H4Cl2O
structure
Isomeric_Smiles CC(C)N1C2=CC=CC=C2C(=C1/C=C\C(=O)C[C@H](CC(=O)OC(C)(C)C)O)C3=CC=C(C=C3)F
Cannoical_Smiles CC(C)N1C2=CC=CC=C2C(=C1C=CC(=O)CC(CC(=O)OC(C)(C)C)O)C3=CC=C(C=C3)F
Gotenzyme_Smiles ClCOCCl