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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 C15330
pubchemid 17396327
name 3beta-Fluoro-5alpha-androstan-17beta-ol
formula C19H31FO
structure
Isomeric_Smiles CC1CCCN(C1)C(=O)CSC2=NN=C(S2)NC3=CC(=CC=C3)F
Cannoical_Smiles CC1CCCN(C1)C(=O)CSC2=NN=C(S2)NC3=CC(=CC=C3)F
Gotenzyme_Smiles C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@@H](F)CC[C@@]43C)[C@@H]1CC[C@@H]2O