生物智能计算平台


化合物信息

名称 内容
kegg编号 C19643
pubchemid 135626115
name Scillarenin
formula C24H32O4
structure
Isomeric_Smiles CC(C)(C)OC(=O)CCC(C(=O)NC(CCCCNC(=O)OC(C)(C)C)C(=O)C(=O)NC(CCCN/C(=N/[N+](=O)[O-])/N)C(=O)C(=O)NCCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2
Cannoical_Smiles CC(C)(C)OC(=O)CCC(C(=O)NC(CCCCNC(=O)OC(C)(C)C)C(=O)C(=O)NC(CCCNC(=N[N+](=O)[O-])N)C(=O)C(=O)NCCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2
Gotenzyme_Smiles C[C@]12CC[C@H](O)C=C1CCC1C2CC[C@]2(C)[C@@H](c3ccc(=O)oc3)CC[C@]12O