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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 C18137
pubchemid 96024354
name 2,2',4,4',5,5'-Hexabromodiphenyl ether
formula C12H4Br6O
structure
Isomeric_Smiles CC1=C(C2=C(CCN[C@@H]2C(=C)C3=CC=CC=C3)C=C1)C
Cannoical_Smiles CC1=C(C2=C(CCNC2C(=C)C3=CC=CC=C3)C=C1)C
Gotenzyme_Smiles Brc1cc(Br)c(Oc2cc(Br)c(Br)cc2Br)cc1Br