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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 C00601
pubchemid 3876
name Phenylacetaldehyde
formula C8H8O
structure
Isomeric_Smiles COC1=C(C=C(C=C1)C2=C3C4=CC(=C(C=C4CCN3C5=C(OC6=CC(=O)C(=CC6=C25)OC)O)OC)OC)O
Cannoical_Smiles COC1=C(C=C(C=C1)C2=C3C4=CC(=C(C=C4CCN3C5=C(OC6=CC(=O)C(=CC6=C25)OC)O)OC)OC)O
Gotenzyme_Smiles O=CCc1ccccc1