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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 C05477
pubchemid 7837
name 21-Hydroxy-5beta-pregnane-3,11,20-trione
formula C21H30O4
structure
Isomeric_Smiles CC(=C)C(=O)OCC1CO1
Cannoical_Smiles CC(=C)C(=O)OCC1CO1
Gotenzyme_Smiles C[C@]12CC(=O)[C@H]3[C@@H](CCC4CC(=O)CC[C@@]43C)[C@@H]1CCC2C(=O)CO