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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 C18445
pubchemid 124489119
name Chloropicrin
formula CCl3NO2
structure
Isomeric_Smiles COC1=CC=CC=C1CNC(=O)C(=O)NC[C@@](C2CC2)(C3=CC=CC=C3)O
Cannoical_Smiles COC1=CC=CC=C1CNC(=O)C(=O)NCC(C2CC2)(C3=CC=CC=C3)O
Gotenzyme_Smiles O=[N+]([O-])C(Cl)(Cl)Cl