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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 C07629
pubchemid 9831
name Desogestrel
formula C22H30O
structure
Isomeric_Smiles CC1=CC=C(C=C1)NC(=O)CF
Cannoical_Smiles CC1=CC=C(C=C1)NC(=O)CF
Gotenzyme_Smiles C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CCCC[C@@H]4[C@H]3C(=C)C[C@@]21CC