生物智能计算平台

化合物信息

名称 内容
kegg编号 C07601
pubchemid 9803
name Ginkgolide A
formula C20H24O9
structure
Isomeric_Smiles CC[N+](CC)(CC)CCOC(=O)C1=C(C(=C(C=C1)OC)OC)OC.CC1=CC=C(C=C1)S(=O)(=O)[O-]
Cannoical_Smiles CC[N+](CC)(CC)CCOC(=O)C1=C(C(=C(C=C1)OC)OC)OC.CC1=CC=C(C=C1)S(=O)(=O)[O-]
Gotenzyme_Smiles C[C@@H]1C(=O)O[C@H]2CC34[C@H]5C[C@@H](C(C)(C)C)C36[C@H](O)C(=O)O[C@H]6O[C@@]4(C(=O)O5)[C@]21O