Chem
J-GLOBAL ID：200907057321703994   Nikkaji number：J1.219.585K

Immucillin HP

インムシリンHP
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： C11H15N4O7P
Molecular formula furigana： C11-H15-N4-O7-P
Molecular weight： 346.236
InChI： InChI=1S/C11H15N4O7P/c16-9-5(2-22-23(19,20)21)15-7(10(9)17)4-1-12-8-6(4)13-3-14-11(8)18/h1,3,5,7,9-10,12,15-17H,2H2,(H,13,14,18)(H2,19,20,21)/t5-,7+,9-,10+/m1/s1
InChI key： VJTAXXUIRYOXBT-KUBHLMPHSA-N
SMILES： O[C@@H]1[C@@H](COP(=O)(O)O)N[C@H]([C@@H]1O)c1c[nH]c2c1nc[nH]c2=O
Systematic name  (4)：
  • 7-[(2S)-3α,4α-ジヒドロキシ-5β-(ホスホノオキシメチル)ピロリジン-2β-イル]-5H-ピロロ[3,2-d]ピリミジン-4(3H)-オン
  • 7-[(2S,3S,4R,5R)-3,4-ジヒドロキシ-5-(ホスホノオキシメチル)-2-ピロリジニル]-1,5-ジヒドロ-4H-ピロロ[3,2-d]ピリミジン-4-オン
  • {[(2R,3R,4S,5S)-3,4-ジヒドロキシ-5-{4-オキソ-3H,4H,5H-ピロロ[3,2-d]ピリミジン-7-イル}ピロリジン-2-イル]メトキシ}ホスホン酸
  • {[(2R,3R,4S,5S)-3,4-dihydroxy-5-{4-oxo-3H,4H,5H-pyrrolo[3,2-d]pyrimidin-7-yl}pyrrolidin-2-yl]methoxy}phosphonic acid
Other name (6)：
  • 7-[(2S)-3α,4α-Dihydroxy-5β-(phosphonooxymethyl)pyrrolidine-2β-yl]-5H-pyrrolo[3,2-d]pyrimidine-4(3H)-one
  • インムシリンHP
  • Immucillin HP
  • 7-[(2S,3S,4R,5R)-3,4-Dihydroxy-5-(phosphonooxymethyl)-2-pyrrolidinyl]-1,5-dihydro-4H-pyrrolo[3,2-d]pyrimidine-4-one
  • Immucillin-H 5′-phosphate
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