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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 C10729
pubchemid 12912
name alpha-Peltatin
formula C21H20O8
structure
Isomeric_Smiles C1=CC=C(C=C1)C(=O)NNC2=CC=C(C=CC2=O)N=O
Cannoical_Smiles C1=CC=C(C=C1)C(=O)NNC2=CC=C(C=CC2=O)N=O
Gotenzyme_Smiles COc1cc([C@@H]2c3cc4c(c(O)c3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1O