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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 C18724
pubchemid 124489398
name Endothal-disodium
formula C8H8O5. 2Na
structure
Isomeric_Smiles CNC[C@H]1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC
Cannoical_Smiles CNCC1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC
Gotenzyme_Smiles O=C([O-])C1C2CCC(O2)C1C(=O)[O-].[Na+].[Na+]