生物智能计算平台


化合物信息

名称 内容
kegg编号 C02117
pubchemid 5197
name 2-Oxophytanate
formula C20H38O3
structure
Isomeric_Smiles CC(=CCCC1(C=CC2=C(O1)C=CC3=C2C(=O)C(=O)C(=C4C(=C5C(=O)C6=C(C7=C(C=C6)OC(C=C7)(C)CCC=C(C)C)C(=O)C5=O)C(=C8C=CC=CC8=C4O)O)C3=O)C)C
Cannoical_Smiles CC(=CCCC1(C=CC2=C(O1)C=CC3=C2C(=O)C(=O)C(=C4C(=C5C(=O)C6=C(C7=C(C=C6)OC(C=C7)(C)CCC=C(C)C)C(=O)C5=O)C(=C8C=CC=CC8=C4O)O)C3=O)C)C
Gotenzyme_Smiles CC(C)CCCC(C)CCCC(C)CCCC(C)C(=O)C(=O)O