Chem
J-GLOBAL ID：200907057538387039   Nikkaji number：J1.494.467B

N6-(2-Phenylethyl)-ATP

N6-(2-フェニルエチル)-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： C18H24N5O13P3
Molecular formula furigana： C18-H24-N5-O13-P3
Molecular weight： 611.333
InChI： InChI=1S/C18H24N5O13P3/c24-14-12(8-33-38(29,30)36-39(31,32)35-37(26,27)28)34-18(15(14)25)23-10-22-13-16(20-9-21-17(13)23)19-7-6-11-4-2-1-3-5-11/h1-5,9-10,12,14-15,18,24-25H,6-8H2,(H,29,30)(H,31,32)(H,19,20,21)(H2,26,27,28)/t12-,14-,15-,18-/m1/s1
InChI key： PSPRNONTFBJUDQ-SCFUHWHPSA-N
SMILES： O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O[C@H]([C@@H]1O)n1cnc2c(NCCc3ccccc3)ncnc12
Systematic name  (4)：
  • N-フェネチルアデノシン5′-三りん酸
  • N-(2-フェニルエチル)アデノシン5′-三りん酸
  • ({[({[(2R,3S,4R,5R)-3,4-ジヒドロキシ-5-{6-[(2-フェニルエチル)アミノ]-9H-プリン-9-イル}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,4R,5R)-3,4-dihydroxy-5-{6-[(2-phenylethyl)amino]-9H-purin-9-yl}oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
Other name (4)：
  • N-Phenethyladenosine 5′-triphosphoric acid
  • N-(2-Phenylethyl)adenosine 5′-triphosphoric acid
  • N6-(2-フェニルエチル)-ATP
  • N6-(2-Phenylethyl)-ATP
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