Chem
J-GLOBAL ID：200907093555412205   Nikkaji number：J136.591F

8-Bromoadenosine

8-ブロモアデノシン
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： C10H12BrN5O4
Molecular formula furigana： C10-H12-BR-N5-O4
Molecular weight： 346.141
InChI： InChI=1S/C10H12BrN5O4/c11-10-15-4-7(12)13-2-14-8(4)16(10)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2,(H2,12,13,14)/t3-,5-,6-,9-/m1/s1
InChI key： VJUPMOPLUQHMLE-UUOKFMHZSA-N
SMILES： Nc1ncnc2n([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c(Br)nc12
Systematic name  (3)：
  • 8-ブロモアデノシン
  • (2R,3R,4S,5R)-2-(6-アミノ-8-ブロモ-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-8-bromo-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
Other name (1)：
  • 8-Bromoadenosine
CAS registry number： 2946-39-6
Regulation number (2)：
  • (9)-1273
  • EINECS2209590
KEGG COMPOUND： C11266
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