Chem
J-GLOBAL ID：200907038589418813   Nikkaji number：J1.466.027E

1-(2-Amino-4-oxo-5-(5-amino-1-pentynyl)-3,4-dihydro-7H-pyrrolo[2,3-d]pyrimidine-7-yl)-1,2-dideoxy-β-D-erythro-pentofuranose 5-triphosphoric acid

1-(2-アミノ-4-オキソ-5-(5-アミノ-1-ペンチニル)-3,4-ジヒドロ-7H-ピロロ[2,3-d]ピリミジン-7-イル)-1,2-ジデオキシ-β-D-erythro-ペントフラノース5-三りん酸
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： C16H24N5O13P3
Molecular formula furigana： C16-H24-N5-O13-P3
Molecular weight： 587.311
InChI： InChI=1S/C16H24N5O13P3/c17-5-3-1-2-4-9-7-21(14-13(9)15(23)20-16(18)19-14)12-6-10(22)11(32-12)8-31-36(27,28)34-37(29,30)33-35(24,25)26/h7,10-12,22H,1,3,5-6,8,17H2,(H,27,28)(H,29,30)(H2,24,25,26)(H3,18,19,20,23)/t10-,11+,12+/m0/s1
InChI key： XIWGGMXHUSVMFH-QJPTWQEYSA-N
SMILES： NCCCC#Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c2nc(N)[nH]c(=O)c12
Systematic name  (3)：
  • 1-(2-アミノ-4-オキソ-5-(5-アミノ-1-ペンチニル)-3,4-ジヒドロ-7H-ピロロ[2,3-d]ピリミジン-7-イル)-1,2-ジデオキシ-β-D-erythro-ペントフラノース5-三りん酸
  • ({[({[(2R,3S,5R)-5-[2-アミノ-5-(5-アミノペンタ-1-イン-1-イル)-4-オキソ-3H,4H,7H-ピロロ[2,3-d]ピリミジン-7-イル]-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}オキシ)ホスホン酸
  • ({[({[(2R,3S,5R)-5-[2-amino-5-(5-aminopent-1-yn-1-yl)-4-oxo-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-7-yl]-3-hydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
Other name (1)：
  • 1-(2-Amino-4-oxo-5-(5-amino-1-pentynyl)-3,4-dihydro-7H-pyrrolo[2,3-d]pyrimidine-7-yl)-1,2-dideoxy-β-D-erythro-pentofuranose 5-triphosphoric acid
Thsaurus map：
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