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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 C09537
pubchemid 11728
name Quadrone
formula C15H20O3
structure
Isomeric_Smiles C[NH2+]C.CN(C)C(=S)[S-]
Cannoical_Smiles C[NH2+]C.CN(C)C(=S)[S-]
Gotenzyme_Smiles CC1(C)C[C@]23[C@@H]4CC[C@H]1[C@@H]2CC(=O)[C@H]3COC4=O