生物智能计算平台

化合物信息

名称 内容
kegg编号 C07302
pubchemid 9510
name 3-Hydroxy-3-(3-hydroxy-4-methoxyphenyl)propionyl-CoA
formula C31H46N7O20P3S
structure
Isomeric_Smiles C1=CC(=CC(=C1)Cl)NCC(F)F
Cannoical_Smiles C1=CC(=CC(=C1)Cl)NCC(F)F
Gotenzyme_Smiles COc1ccc(C(O)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2OP(=O)(O)O)cc1O