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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 C17688
pubchemid 163311807
name Aluminum acetoacetate
formula (C4H5O3)3. Al
structure
Isomeric_Smiles CCC(CCCO)(CNC1=NOC(=C1C(=O)O)C2=CC=CC=C2)O
Cannoical_Smiles CCC(CCCO)(CNC1=NOC(=C1C(=O)O)C2=CC=CC=C2)O
Gotenzyme_Smiles CC(=O)CC(=O)[O-].CC(=O)CC(=O)[O-].CC(=O)CC(=O)[O-].[Al+3]