生物智能计算平台


化合物信息

名称 内容
kegg编号 C11632
pubchemid 13797
name Polyneuridine aldehyde
formula C21H22N2O3
structure
Isomeric_Smiles CC[NH+](CC)CCC1=CC(=NO1)C2=CC=CC=C2.C(C(=O)O)C(CC(=O)O)(C(=O)[O-])O
Cannoical_Smiles CC[NH+](CC)CCC1=CC(=NO1)C2=CC=CC=C2.C(C(=O)O)C(CC(=O)O)(C(=O)[O-])O
Gotenzyme_Smiles C/C=C1/CN2[C@H]3C[C@@H]1C(C=O)(C(=O)OC)[C@@H]2Cc1c3[nH]c2ccccc12