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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 C08454
pubchemid 10647
name (E,E,E)-N-(2-Methylpropyl)hexadeca-2,6,8-trien-10-ynamide
formula C20H31NO
structure
Isomeric_Smiles C1=COC(=C1)C(=C(C2=CC=CO2)N=O)NO
Cannoical_Smiles C1=COC(=C1)C(=C(C2=CC=CO2)N=O)NO
Gotenzyme_Smiles CCCCCC#C/C=C/C=C/CC/C=C/C(=O)NCC(C)C