Chem
J-GLOBAL ID：200907080147214280   Nikkaji number：J1.642.670I

2-Chloro-9-[3-(phosphonooxymethyl)-4-(phosphonooxy)-2-butenyl]-N-methyl-9H-purine-6-amine

2-クロロ-9-[3-(ホスホノオキシメチル)-4-(ホスホノオキシ)-2-ブテニル]-N-メチル-9H-プリン-6-アミン
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： C11H16ClN5O8P2
Molecular formula furigana： C11-H16-CL-N5-O8-P2
Molecular weight： 443.670
InChI： InChI=1S/C11H16ClN5O8P2/c1-13-9-8-10(16-11(12)15-9)17(6-14-8)3-2-7(4-24-26(18,19)20)5-25-27(21,22)23/h2,6H,3-5H2,1H3,(H,13,15,16)(H2,18,19,20)(H2,21,22,23)
InChI key： HSEYIZMENQZQTL-UHFFFAOYSA-N
SMILES： CNc1nc(Cl)nc2n(CC=C(COP(=O)(O)O)COP(=O)(O)O)cnc12
Systematic name  (3)：
  • 2-クロロ-9-[3-(ホスホノオキシメチル)-4-(ホスホノオキシ)-2-ブテニル]-N-メチル-9H-プリン-6-アミン
  • ({4-[2-クロロ-6-(メチルアミノ)-9H-プリン-9-イル]-2-[(ホスホノオキシ)メチル]ブタ-2-エン-1-イル}オキシ)ホスホン酸
  • ({4-[2-chloro-6-(methylamino)-9H-purin-9-yl]-2-[(phosphonooxy)methyl]but-2-en-1-yl}oxy)phosphonic acid
Other name (1)：
  • 2-Chloro-9-[3-(phosphonooxymethyl)-4-(phosphonooxy)-2-butenyl]-N-methyl-9H-purine-6-amine
Thsaurus map：
Thesaurus Map

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