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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 C09097
pubchemid 11289
name Calycanthidine
formula C23H28N4
structure
Isomeric_Smiles COC1=CC=C(C=C1)C(=C(C2=CC=C(C=C2)OC)Cl)C3=CC=C(C=C3)OC
Cannoical_Smiles COC1=CC=C(C=C1)C(=C(C2=CC=C(C=C2)OC)Cl)C3=CC=C(C=C3)OC
Gotenzyme_Smiles CN1CC[C@]2([C@]34CCN(C)[C@H]3Nc3ccccc34)c3ccccc3N(C)[C@H]12