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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 C17047
pubchemid 96023525
name Phellopterin
formula C17H16O5
structure
Isomeric_Smiles CC1=NC(=CC=C1)[C@H]2C3=C(CCN2)C=CC(=C3F)O
Cannoical_Smiles CC1=NC(=CC=C1)C2C3=C(CCN2)C=CC(=C3F)O
Gotenzyme_Smiles COc1c2ccoc2c(OCC=C(C)C)c2oc(=O)ccc12