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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 C12258
pubchemid 14403
name Arnottin II
formula C20H14O7
structure
Isomeric_Smiles COC1=C2C3=C(C(=O)CC3)C(=O)OC2=C4C5C=COC5OC4=C1
Cannoical_Smiles COC1=C2C3=C(C(=O)CC3)C(=O)OC2=C4C5C=COC5OC4=C1
Gotenzyme_Smiles COc1ccc2c(c1OC)C(=O)O[C@]21C=Cc2cc3c(cc2C1=O)OCO3