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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 C09990
pubchemid 12176
name Thiobinupharidine
formula C30H42N2O2S
structure
Isomeric_Smiles CCOC(=O)CN
Cannoical_Smiles CCOC(=O)CN
Gotenzyme_Smiles C[C@@H]1CC[C@@H](c2ccoc2)N2C[C@@]3(CC[C@@H]12)CS[C@@]1(CC[C@H]2[C@H](C)CC[C@@H](c4ccoc4)N2C1)C3