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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 C14423
pubchemid 17395423
name 1,8-Dinitropyrene
formula C16H8N2O4
structure
Isomeric_Smiles CC1=NC(=CC=C1)NC(=O)C2=CC(=C(C=C2)OC)Br
Cannoical_Smiles CC1=NC(=CC=C1)NC(=O)C2=CC(=C(C=C2)OC)Br
Gotenzyme_Smiles O=[N+]([O-])c1ccc2ccc3ccc([N+](=O)[O-])c4ccc1c2c34