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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 C14212
pubchemid 7847022
name Nafoxidine
formula C29H31NO2
structure
Isomeric_Smiles CCCCC1=CC=C(C=C1)NC(=O)COC(=O)CCC2=NC3=CC=CC=C3S2
Cannoical_Smiles CCCCC1=CC=C(C=C1)NC(=O)COC(=O)CCC2=NC3=CC=CC=C3S2
Gotenzyme_Smiles COc1ccc2c(c1)CCC(c1ccccc1)=C2c1ccc(OCCN2CCCC2)cc1