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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 C15420
pubchemid 17396417
name 5alpha-Pregn-2-en-20-one
formula C21H32O
structure
Isomeric_Smiles COC1=C(C=C(C=C1)C2=NC(=CS2)CC(=O)NCC3=CC=NC=C3)OC
Cannoical_Smiles COC1=C(C=C(C=C1)C2=NC(=CS2)CC(=O)NCC3=CC=NC=C3)OC
Gotenzyme_Smiles CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC=CC[C@]4(C)[C@H]3CC[C@]12C