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MTC 智能计算中心MTC Computing Center AI × 蛋白质与酶工程AI for Protein & Enzyme Engineering

化合物信息

名称 内容
kegg编号 C15081
pubchemid 17396078
name trans-1,3,4,6,7,11b-Hexahydro-9-methoxy-2H-benzo[a]quinolizine-3-carboxylic acid ethyl ester
formula C17H23NO3
structure
Isomeric_Smiles CCOCC1=C(OC2=CC=CC=C21)C(=O)N3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCO5
Cannoical_Smiles CCOCC1=C(OC2=CC=CC=C21)C(=O)N3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCO5
Gotenzyme_Smiles CCOC(=O)[C@H]1CC[C@H]2c3ccc(OC)cc3CCN2C1