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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 C19664
pubchemid 135626132
name Ergostane
formula C28H50
structure
Isomeric_Smiles CC(C)C[C@@H]([C@H](CC=C)C(=O)O)C(=O)N[C@H]1CCCCN(C1=O)CC2=CC(=CC=C2)OC3=CC=CC=C3
Cannoical_Smiles CC(C)CC(C(CC=C)C(=O)O)C(=O)NC1CCCCN(C1=O)CC2=CC(=CC=C2)OC3=CC=CC=C3
Gotenzyme_Smiles CC(C)[C@@H](C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4CCCC[C@]4(C)[C@H]3CC[C@@]21C