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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 C12729
pubchemid 583118
name Chlormadinone acetate
formula C23H29ClO4
structure
Isomeric_Smiles C1CN2CC(=O)CN1C3=CC=CC=C32
Cannoical_Smiles C1CN2CC(=O)CN1C3=CC=CC=C32
Gotenzyme_Smiles CC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3C=C(Cl)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C