Chem
J-GLOBAL ID：200907079597199380   Nikkaji number：J2.716.410B

7-[[(3S)-3α,4α-Dihydroxy-5β-(hydroxymethyl)pyrrolidine-1-yl]methyl]-5H-pyrrolo[3,2-d]pyrimidine-4(3H)-one

7-[[(3S)-3α,4α-ジヒドロキシ-5β-(ヒドロキシメチル)ピロリジン-1-イル]メチル]-5H-ピロロ[3,2-d]ピリミジン-4(3H)-オン
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： C12H16N4O4
Molecular formula furigana： C12-H16-N4-O4
Molecular weight： 280.284
InChI： InChI=1S/C12H16N4O4/c17-4-7-11(19)8(18)3-16(7)2-6-1-13-10-9(6)14-5-15-12(10)20/h1,5,7-8,11,13,17-19H,2-4H2,(H,14,15,20)/t7-,8+,11-/m1/s1
InChI key： OKGGSJRJIFFOGK-VHSKPIJISA-N
SMILES： OC[C@@H]1[C@@H](O)[C@@H](O)CN1Cc1c[nH]c2c1nc[nH]c2=O
Systematic name  (3)：
  • 7-[[(3S)-3α,4α-ジヒドロキシ-5β-(ヒドロキシメチル)ピロリジン-1-イル]メチル]-5H-ピロロ[3,2-d]ピリミジン-4(3H)-オン
  • 7-{[(2R,3R,4S)-3,4-ジヒドロキシ-2-(ヒドロキシメチル)ピロリジン-1-イル]メチル}-3H,4H,5H-ピロロ[3,2-d]ピリミジン-4-オン
  • 7-{[(2R,3R,4S)-3,4-dihydroxy-2-(hydroxymethyl)pyrrolidin-1-yl]methyl}-3H,4H,5H-pyrrolo[3,2-d]pyrimidin-4-one
Other name (1)：
  • 7-[[(3S)-3α,4α-Dihydroxy-5β-(hydroxymethyl)pyrrolidine-1-yl]methyl]-5H-pyrrolo[3,2-d]pyrimidine-4(3H)-one
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