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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 C04084
pubchemid 6777
name Pregna-4,9(11)-diene-3,20-dione
formula C21H28O2
structure
Isomeric_Smiles C1CCC(CC1)OC(=O)C2=CC=CC=C2C(=O)OC3CCCCC3
Cannoical_Smiles C1CCC(CC1)OC(=O)C2=CC=CC=C2C(=O)OC3CCCCC3
Gotenzyme_Smiles CC(=O)C1CCC2C3CCC4=CC(=O)CC[C@]4(C)C3=CC[C@]12C