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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 C15355
pubchemid 17396352
name 11alpha-Hydroxy-5beta-pregnane-3,20-dione
formula C21H32O3
structure
Isomeric_Smiles CC1=CC=CC=C1OCC(=O)NC(C)C2=CC3=C(C=C2)OCCO3
Cannoical_Smiles CC1=CC=CC=C1OCC(=O)NC(C)C2=CC3=C(C=C2)OCCO3
Gotenzyme_Smiles CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4CC(=O)CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C