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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 C18172
pubchemid 96024388
name Carboxyspermidine
formula C8H19N3O2
structure
Isomeric_Smiles CC1=C(C(=CC=C1)Cl)[C@H]2C3=C(CCN2)C=CC(=C3C)C
Cannoical_Smiles CC1=C(C(=CC=C1)Cl)C2C3=C(CCN2)C=CC(=C3C)C
Gotenzyme_Smiles NCCCCNCCC(N)C(=O)O