Chem
J-GLOBAL ID：200907040103697400   Nikkaji number：J1.610.448E

1-(2-O,3-O-Isopropylidene-1-deoxy-4-O-carba-β-D-ribofuranose-1-yl)-9-benzyl-1,6-dihydro-9H-purine-6-imine

1-(2-O,3-O-イソプロピリデン-1-デオキシ-4-O-カルバ-β-D-リボフラノース-1-イル)-9-ベンジル-1,6-ジヒドロ-9H-プリン-6-イミン
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： C21H25N5O3
Molecular formula furigana： C21-H25-N5-O3
Molecular weight： 395.463
InChI： InChI=1S/C21H25N5O3/c1-21(2)28-17-14(10-27)8-15(18(17)29-21)26-12-24-20-16(19(26)22)23-11-25(20)9-13-6-4-3-5-7-13/h3-7,11-12,14-15,17-18,22,27H,8-10H2,1-2H3/t14-,15-,17-,18+/m1/s1
InChI key： IECKUVFBTYTOMQ-AHCXZYCDSA-N
SMILES： CC1(C)O[C@@H]2[C@@H](CO)C[C@H]([C@@H]2O1)n1cnc2n(Cc3ccccc3)cnc2c1=N
Systematic name  (3)：
  • 1-(2-O,3-O-イソプロピリデン-1-デオキシ-4-O-カルバ-β-D-リボフラノース-1-イル)-9-ベンジル-1,6-ジヒドロ-9H-プリン-6-イミン
  • [(3aR,4R,6R,6aS)-6-(9-ベンジル-6-イミノ-6,9-ジヒドロ-1H-プリン-1-イル)-2,2-ジメチル-ヘキサヒドロシクロペンタ[d][1,3]ジオキソール-4-イル]メタノール
  • [(3aR,4R,6R,6aS)-6-(9-benzyl-6-imino-6,9-dihydro-1H-purin-1-yl)-2,2-dimethyl-hexahydrocyclopenta[d][1,3]dioxol-4-yl]methanol
Other name (1)：
  • 1-(2-O,3-O-Isopropylidene-1-deoxy-4-O-carba-β-D-ribofuranose-1-yl)-9-benzyl-1,6-dihydro-9H-purine-6-imine
Thsaurus map：
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