Chem
J-GLOBAL ID：200907020871428914   Nikkaji number：J1.069.521J

2′-Bromo-2′-deoxyadenosine 5′-[β,γ-imide]triphosphoric acid

2′-ブロモ-2′-デオキシアデノシン5′-[β,γ-イミド]三りん酸
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： C10H16BrN6O11P3
Molecular formula furigana： C10-H16-BR-N6-O11-P3
Molecular weight： 569.094
InChI： InChI=1S/C10H16BrN6O11P3/c11-5-7(18)4(1-26-31(24,25)28-30(22,23)16-29(19,20)21)27-10(5)17-3-15-6-8(12)13-2-14-9(6)17/h2-5,7,10,18H,1H2,(H,24,25)(H2,12,13,14)(H4,16,19,20,21,22,23)/t4-,5-,7-,10-/m1/s1
InChI key： GLCRVGHVCJLAHS-QYYRPYCUSA-N
SMILES： Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)NP(=O)(O)O)[C@@H](O)[C@H]1Br
Systematic name  (3)：
  • 2′-ブロモ-2′-デオキシアデノシン5′-[β,γ-イミド]三りん酸
  • ({[({[(2R,3R,4R,5R)-5-(6-アミノ-9H-プリン-9-イル)-4-ブロモ-3-ヒドロキシオキソラン-2-イル]メトキシ}(ヒドロキシ)ホスホリル)オキシ](ヒドロキシ)ホスホリル}アミノ)ホスホン酸
  • ({[({[(2R,3R,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-bromo-3-hydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}amino)phosphonic acid
Other name (1)：
  • 2′-Bromo-2′-deoxyadenosine 5′-[β,γ-imide]triphosphoric acid
Thsaurus map：
Thesaurus Map

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