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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 C11177
pubchemid 13358
name Rhodamine 6G
formula C28H31N2O3. Cl
structure
Isomeric_Smiles CCOC(=O)[C@H](CS)[NH3+].[Cl-]
Cannoical_Smiles CCOC(=O)C(CS)[NH3+].[Cl-]
Gotenzyme_Smiles CCNc1cc2[o+]c3cc(NCC)c(C)cc3c(-c3ccccc3C(=O)OCC)c2cc1C.[Cl-]