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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 C17031
pubchemid 96023510
name Nigakilactone F
formula C22H32O7
structure
Isomeric_Smiles CC1=NC=C(C=C1)[C@@H]2C3=CC(=C(C=C3CCN2)F)O
Cannoical_Smiles CC1=NC=C(C=C1)C2C3=CC(=C(C=C3CCN2)F)O
Gotenzyme_Smiles COC1=C[C@@H](C)[C@@H]2C[C@H]3OC(=O)C[C@H]4[C@](C)(O)[C@H](OC)[C@@H](O)[C@H]([C@@]2(C)C1=O)[C@@]34C