Chem
J-GLOBAL ID:200907044801169497   Nikkaji number:J1.461.547D

(5β)-4β-(2,6-Diamino-9H-purine-9-yl)-2α-hydroxybicyclo[3.1.0]hexane-1β-methanol

(5β)-4β-(2,6-ジアミノ-9H-プリン-9-イル)-2α-ヒドロキシビシクロ[3.1.0]ヘキサン-1β-メタノール
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: C12H16N6O2
Molecular formula furigana: C12-H16-N6-O2
Molecular weight: 276.300
InChI: InChI=1S/C12H16N6O2/c13-9-8-10(17-11(14)16-9)18(4-15-8)6-1-7(20)12(3-19)2-5(6)12/h4-7,19-20H,1-3H2,(H4,13,14,16,17)/t5-,6+,7+,12+/m0/s1
InChI key: WLFVHPBMUBYMHP-WGVJZOHMSA-N
SMILES: Nc1nc(N)c2ncn([C@@H]3C[C@@H](O)[C@@]4(CO)C[C@@H]34)c2n1
Systematic name  (3):
  • (5β)-4β-(2,6-ジアミノ-9H-プリン-9-イル)-2α-ヒドロキシビシクロ[3.1.0]ヘキサン-1β-メタノール
  • (1S,2R,4R,5R)-4-(2,6-ジアミノ-9H-プリン-9-イル)-1-(ヒドロキシメチル)ビシクロ[3.1.0]ヘキサン-2-オール
  • (1S,2R,4R,5R)-4-(2,6-diamino-9H-purin-9-yl)-1-(hydroxymethyl)bicyclo[3.1.0]hexan-2-ol
Other name (1):
  • (5β)-4β-(2,6-Diamino-9H-purine-9-yl)-2α-hydroxybicyclo[3.1.0]hexane-1β-methanol
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