生物智能计算平台

化合物信息

名称 内容
kegg编号 C15254
pubchemid 17396251
name 3-(Allyloxy)estra-1,3,5(10)-triene-16alpha,17beta-diol
formula C21H28O3
structure
Isomeric_Smiles CC(=O)NCC1=CC=C(C=C1)C2=NN=C(SC2)NC3=CC(=CC=C3)Cl
Cannoical_Smiles CC(=O)NCC1=CC=C(C=C1)C2=NN=C(SC2)NC3=CC(=CC=C3)Cl
Gotenzyme_Smiles C=CCOc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1C[C@@H](O)[C@@H]2O