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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 C14600
pubchemid 17395600
name 16alpha-Hydroxytestosterone
formula C19H28O3
structure
Isomeric_Smiles CC(C(=O)N1CCNC1=O)SC2=NN=C(N2C3CCCCC3)CNC4=CC(=CC=C4)OC
Cannoical_Smiles CC(C(=O)N1CCNC1=O)SC2=NN=C(N2C3CCCCC3)CNC4=CC(=CC=C4)OC
Gotenzyme_Smiles C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1C[C@@H](O)[C@@H]2O