Chem
J-GLOBAL ID：200907051256279324   Nikkaji number：J413.564D

ara-ATP

ara-ATP
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： C10H16N5O13P3
Molecular formula furigana： C10-H16-N5-O13-P3
Molecular weight： 507.181
InChI： InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/t4-,6-,7+,10-/m1/s1
InChI key： ZKHQWZAMYRWXGA-UHTZMRCNSA-N
SMILES： Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@@H]1O
Systematic name  (5)：
  • 1-(6-アミノ-9H-プリン-9-イル)-1-デオキシ-β-D-アラビノフラノース5-三りん酸
  • 9-[5-O-[[(ホスホノオキシ)ホスホニルオキシ]ホスホニル]-β-D-アラビノフラノシル]-9H-プリン-6-アミン
  • 1β-(6-アミノ-9H-プリン-9-イル)-1-デオキシ-α-D-アラビノフラノース5-三りん酸
  • ({[({[(2R,3S,4S,5R)-5-(6-アミノ-9H-プリン-9-イル)-3,4-ジ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}オキシ)ホスホン酸
  • ({[({[(2R,3S,4S,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
Other name (10)：
  • ara-ATP
  • アラビノ-ATP
  • Arabino-ATP
  • 1-(6-Amino-9H-purin-9-yl)-1-deoxy-β-D-arabinofuranose 5-triphosphoric acid
  • 9-[5-O-[[(Phosphonooxy)phosphonyloxy]phosphonyl]-β-D-arabinofuranosyl]-9H-purine-6-amine
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CAS registry number： 3714-60-1
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