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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 C09733
pubchemid 11921
name Sirenin
formula C15H24O2
structure
Isomeric_Smiles C1=CC=C(C(=C1)CCl)[N+](=O)[O-]
Cannoical_Smiles C1=CC=C(C(=C1)CCl)[N+](=O)[O-]
Gotenzyme_Smiles C/C(=C\CC[C@@]1(C)[C@@H]2C=C(CO)CC[C@@H]21)CO