Chem
J-GLOBAL ID:200907031952608099   Nikkaji number:J1.069.572D

1,9-Dihydro-2-amino-9-[(5β-phosphonotetrahydrofuran-2α-yl)methyl]-6H-purine-6-one

1,9-ジヒドロ-2-アミノ-9-[(5β-ホスホノテトラヒドロフラン-2α-イル)メチル]-6H-プリン-6-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: C10H14N5O5P
Molecular formula furigana: C10-H14-N5-O5-P
Molecular weight: 315.226
InChI: InChI=1S/C10H14N5O5P/c11-10-13-8-7(9(16)14-10)12-4-15(8)3-5-1-2-6(20-5)21(17,18)19/h4-6H,1-3H2,(H2,17,18,19)(H3,11,13,14,16)/t5-,6+/m0/s1
InChI key: WMVVWDCCZZNNEX-NTSWFWBYSA-N
SMILES: Nc1nc2n(C[C@@H]3CC[C@H](O3)P(=O)(O)O)cnc2c(=O)[nH]1
Systematic name  (5):
  • [(2R,5S)-テトラヒドロ-5-[(1,6-ジヒドロ-2-アミノ-6-オキソ-9H-プリン-9-イル)メチル]フラン-2-イル]ホスホン酸
  • 1,9-ジヒドロ-2-アミノ-9-[(5β-ホスホノテトラヒドロフラン-2α-イル)メチル]-6H-プリン-6-オン
  • 2-アミノ-9-[[(2S)-5β-ホスホノテトラヒドロフラン-2α-イル]メチル]-6,9-ジヒドロ-1H-プリン-6-オン
  • [(2R,5S)-5-[(2-アミノ-6-オキソ-6,9-ジヒドロ-1H-プリン-9-イル)メチル]オキソラン-2-イル]ホスホン酸
  • [(2R,5S)-5-[(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)methyl]oxolan-2-yl]phosphonic acid
Other name (3):
  • [(2R,5S)-Tetrahydro-5-[(1,6-dihydro-2-amino-6-oxo-9H-purine-9-yl)methyl]furan-2-yl]phosphonic acid
  • 1,9-Dihydro-2-amino-9-[(5β-phosphonotetrahydrofuran-2α-yl)methyl]-6H-purine-6-one
  • 2-Amino-9-[[(2S)-5β-phosphonotetrahydrofuran-2α-yl]methyl]-6,9-dihydro-1H-purine-6-one
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