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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 C12193
pubchemid 14339
name Vittatine
formula C16H17NO3
structure
Isomeric_Smiles CCCCC1=CC2=CC=CC=C2C=C1
Cannoical_Smiles CCCCC1=CC2=CC=CC=C2C=C1
Gotenzyme_Smiles O[C@@H]1C=C[C@]23CC[N@](Cc4cc5c(cc42)OCO5)[C@H]3C1