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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 C15413
pubchemid 17396410
name 17beta-Hydroxy-4,4,17-trimethylandrost-5-en-3-one
formula C22H34O2
structure
Isomeric_Smiles CCOC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OC(=N3)C)OC
Cannoical_Smiles CCOC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OC(=N3)C)OC
Gotenzyme_Smiles CC1(C)C(=O)CC[C@@]2(C)C1=CC[C@H]1[C@@H]3CC[C@](C)(O)[C@@]3(C)CC[C@@H]12