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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 C16227
pubchemid 47205535
name (+)-Sophorol
formula C16H12O6
structure
Isomeric_Smiles CCCC(=O)NCC(=O)NC1=CC(=CC=C1)Br
Cannoical_Smiles CCCC(=O)NCC(=O)NC1=CC(=CC=C1)Br
Gotenzyme_Smiles O=C1c2ccc(O)cc2OC[C@@H]1c1cc2c(cc1O)OCO2