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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 C14822
pubchemid 17395820
name 12(R)-HETE
formula C20H32O3
structure
Isomeric_Smiles CC(C)C(C1=CC=C(C=C1)Cl)C(=O)NCC2=CC=NC=C2
Cannoical_Smiles CC(C)C(C1=CC=C(C=C1)Cl)C(=O)NCC2=CC=NC=C2
Gotenzyme_Smiles CCCCC/C=C\C[C@@H](O)/C=C/C=C\C/C=C\CCCC(=O)O