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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 C19135
pubchemid 124489807
name Triapenthenol
formula C15H25N3O
structure
Isomeric_Smiles CC(C)(C)OC(=O)[C@H]([C@@H](CC1=CC(=C(C=C1)F)F)N)C(=O)O
Cannoical_Smiles CC(C)(C)OC(=O)C(C(CC1=CC(=C(C=C1)F)F)N)C(=O)O
Gotenzyme_Smiles CC(C)(C)C(O)/C(=C\C1CCCCC1)n1cncn1