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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 C14468
pubchemid 17395468
name Diisopropyl phthalate
formula C14H18O4
structure
Isomeric_Smiles C1C(=O)N(CS1)CC(=O)NCC2=CC=C(C=C2)OC(F)F
Cannoical_Smiles C1C(=O)N(CS1)CC(=O)NCC2=CC=C(C=C2)OC(F)F
Gotenzyme_Smiles CC(C)OC(=O)c1ccccc1C(=O)OC(C)C