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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 C05194
pubchemid 7599
name Dihydrochelirubine
formula C21H17NO5
structure
Isomeric_Smiles COC1=CC=C(C=C1)COC(=O)CC2=CC=CC=C2
Cannoical_Smiles COC1=CC=C(C=C1)COC(=O)CC2=CC=CC=C2
Gotenzyme_Smiles COc1cc2c(c3c1-c1ccc4cc5c(cc4c1N(C)C3)OCO5)OCO2