跳到正文Skip to content
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 C15568
pubchemid 17396560
name 7alpha,12alpha-Dihydroxy-3-oxochol-4-enoate
formula C24H36O5
structure
Isomeric_Smiles CC1=C(C=C(C=C1)NC(=O)C2=C(C(=C(N2)C)C(=O)C)C)Cl
Cannoical_Smiles CC1=C(C=C(C=C1)NC(=O)C2=C(C(=C(N2)C)C(=O)C)C)Cl
Gotenzyme_Smiles C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CCC(=O)C=C1C[C@H]3O