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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 C11365
pubchemid 13539
name Irinotecan carboxylate
formula C33H39N4O7
structure
Isomeric_Smiles CC(COC(=O)C(=C)C)O
Cannoical_Smiles CC(COC(=O)C(=C)C)O
Gotenzyme_Smiles CCc1c2c(nc3ccc(OC(=O)N4CCC(N5CCCCC5)CC4)cc13)-c1cc([C@@](O)(CC)C(=O)[O-])c(CO)c(=O)n1C2