Chem
J-GLOBAL ID：200907035158312784   Nikkaji number：J1.941.555D

4-Amino-1-(2-deoxy-β-D-ribofuranosyl)-1,3,5,6,8-pentaaza-1H-benzo[e]indene-7(6H)-one

4-アミノ-1-(2-デオキシ-β-D-リボフラノシル)-1,3,5,6,8-ペンタアザ-1H-ベンゾ[e]インデン-7(6H)-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： C13H14N6O4
Molecular formula furigana： C13-H14-N6-O4
Molecular weight： 318.293
InChI： InChI=1S/C13H14N6O4/c14-11-9-10(5-2-15-13(22)18-12(5)17-11)19(4-16-9)8-1-6(21)7(3-20)23-8/h2,4,6-8,20-21H,1,3H2,(H3,14,15,17,18,22)/t6-,7+,8+/m0/s1
InChI key： HRWKKKSZLAANES-XLPZGREQSA-N
SMILES： Nc1nc2[nH]c(=O)ncc2c2n(cnc12)[C@H]1C[C@H](O)[C@@H](CO)O1
Systematic name  (3)：
  • 4-アミノ-1-(2-デオキシ-β-D-リボフラノシル)-1,3,5,6,8-ペンタアザ-1H-ベンゾ[e]インデン-7(6H)-オン
  • 7-アミノ-3-[(2R,4S,5R)-4-ヒドロキシ-5-(ヒドロキシメチル)オキソラン-2-イル]-3,5,8,10,12-ペンタアザトリシクロ[7.4.0.02,6]トリデカ-1,4,6,8,12-ペンタエン-11-オン
  • 7-amino-3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3,5,8,10,12-pentaazatricyclo[7.4.0.02,6]trideca-1,4,6,8,12-pentaen-11-one
Other name (1)：
  • 4-Amino-1-(2-deoxy-β-D-ribofuranosyl)-1,3,5,6,8-pentaaza-1H-benzo[e]indene-7(6H)-one
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