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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 C14762
pubchemid 17395760
name 13(S)-HODE
formula C18H32O3
structure
Isomeric_Smiles CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NCC(=O)NC2=CC=CC=C2C(=O)OCC
Cannoical_Smiles CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NCC(=O)NC2=CC=CC=C2C(=O)OCC
Gotenzyme_Smiles CCCCC[C@H](O)/C=C/C=C\CCCCCCCC(=O)O