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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 C19042
pubchemid 124489714
name Kinoprene
formula C18H28O2
structure
Isomeric_Smiles C[C@@H]1CCNC[C@H]1NS(=O)(=O)C2=C(C=C(C=C2)F)C
Cannoical_Smiles CC1CCNCC1NS(=O)(=O)C2=C(C=C(C=C2)F)C
Gotenzyme_Smiles C#CCOC(=O)/C=C(C)/C=C/CC(C)CCCC(C)C