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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 C15342
pubchemid 17396339
name 17beta-Hydroxy-2alpha,17-dimethyl-4,9(11)-androstadien-3-one
formula C21H30O2
structure
Isomeric_Smiles CC(=O)NC1=NC(=CS1)COC(=O)C2=CC=CC3=CC=CC=C32
Cannoical_Smiles CC(=O)NC1=NC(=CS1)COC(=O)C2=CC=CC3=CC=CC=C32
Gotenzyme_Smiles C[C@@H]1C[C@@]2(C)C(=CC1=O)CC[C@@H]1C2=CC[C@@]2(C)[C@H]1CC[C@]2(C)O