Chem
J-GLOBAL ID：200907050527881789   Nikkaji number：J1.265.359J

2-(Butylthio)adenosine

2-(ブチルチオ)アデノシン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C14H21N5O4S
Molecular formula furigana： C14-H21-N5-O4-S
Molecular weight： 355.410
InChI： InChI=1S/C14H21N5O4S/c1-2-3-4-24-14-17-11(15)8-12(18-14)19(6-16-8)13-10(22)9(21)7(5-20)23-13/h6-7,9-10,13,20-22H,2-5H2,1H3,(H2,15,17,18)/t7-,9-,10-,13-/m1/s1
InChI key： JUZWTKSKLZRPBL-QYVSTXNMSA-N
SMILES： CCCCSc1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
Systematic name  (3)：
  • 2-(ブチルチオ)アデノシン
  • (2R,3R,4S,5R)-2-[6-アミノ-2-(ブチルスルファニル)-9H-プリン-9-イル]-5-(ヒドロキシメチル)オキソラン-3,4-ジオール
  • (2R,3R,4S,5R)-2-[6-amino-2-(butylsulfanyl)-9H-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Other name (1)：
  • 2-(Butylthio)adenosine
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