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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 C16583
pubchemid 51090911
name (R)-(Homo)2-citrate
formula C8H12O7
structure
Isomeric_Smiles CCN(CC1CCOC1)C(=O)CC2=CSC(=N2)NC(=O)C(C)C
Cannoical_Smiles CCN(CC1CCOC1)C(=O)CC2=CSC(=N2)NC(=O)C(C)C
Gotenzyme_Smiles O=C(O)CCC[C@@](O)(CC(=O)O)C(=O)O