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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 C15134
pubchemid 17396131
name 3-(1,2,3,4-Tetrahydro-6-hydroxy-2-naphthyl)cyclopentanone
formula C15H18O2
structure
Isomeric_Smiles C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)C3=NC=CN=C3C4=NC5=CC=CC=C5S4
Cannoical_Smiles C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)C3=NC=CN=C3C4=NC5=CC=CC=C5S4
Gotenzyme_Smiles O=C1CCC(C2CCc3cc(O)ccc3C2)C1