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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 C07018
pubchemid 9230
name Gabapentin
formula C9H17NO2
structure
Isomeric_Smiles C1=CC2=CC=CN2C=C1
Cannoical_Smiles C1=CC2=CC=CN2C=C1
Gotenzyme_Smiles NCC1(CC(=O)O)CCCCC1