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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 C09237
pubchemid 11428
name Roxburghine B
formula C31H32N4O2
structure
Isomeric_Smiles CCC(CC)O
Cannoical_Smiles CCC(CC)O
Gotenzyme_Smiles COC(=O)C1=CN2CCc3c([nH]c4ccccc34)[C@@]2(C)[C@@H]2CN3CCc4c([nH]c5ccccc45)[C@H]3C[C@H]12