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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 C09254
pubchemid 11445
name Vobtusine
formula C43H50N4O6
structure
Isomeric_Smiles CC1=CC=CC=C1N=NC2=CC=CC=C2C
Cannoical_Smiles CC1=CC=CC=C1N=NC2=CC=CC=C2C
Gotenzyme_Smiles COC(=O)C1=C2Nc3ccccc3[C@@]23CCN2C[C@]4(C[C@@H]5C[C@]67CCO[C@H]6CCN6CC[C@@]8(c9ccc(OC)cc9N(C4)[C@@]58O)[C@@H]67)[C@@H]4OCC[C@]4(C1)[C@H]23