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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 C15063
pubchemid 17396060
name 3-Methoxy-D-homoestra-1,3,5(10),8,14-pentaen-17abeta-ol
formula C20H24O2
structure
Isomeric_Smiles CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)OCC4=NC(=NO4)C5=CC=CC=C5
Cannoical_Smiles CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)OCC4=NC(=NO4)C5=CC=CC=C5
Gotenzyme_Smiles COc1ccc2c(c1)CCC1=C2CC[C@@]2(C)C1=CCC[C@@H]2O