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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 C10689
pubchemid 12872
name Graveoline
formula C17H13NO3
structure
Isomeric_Smiles C1=C(OC(=C1)[N+](=O)[O-])C=CC=NNC(=O)N
Cannoical_Smiles C1=C(OC(=C1)[N+](=O)[O-])C=CC=NNC(=O)N
Gotenzyme_Smiles Cn1c(-c2ccc3c(c2)OCO3)cc(=O)c2ccccc21