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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 C15255
pubchemid 17396252
name 1-Methylestra-1,3,5(10),6-tetraene-3,17beta-diol
formula C19H24O2
structure
Isomeric_Smiles CC1=C(C=C(C=C1)CNC(=O)C2=CC3=C(C(=C2)OC)OCCO3)F
Cannoical_Smiles CC1=C(C=C(C=C1)CNC(=O)C2=CC3=C(C(=C2)OC)OCCO3)F
Gotenzyme_Smiles Cc1cc(O)cc2c1[C@H]1CC[C@]3(C)[C@@H](O)CC[C@H]3[C@@H]1C=C2