Chem
J-GLOBAL ID:200907064326135257   Nikkaji number:J2.394.120A

5′-Adenylic acid (R)-2,4-dihydroxy-3,3-dimethylbutyryl ester

5′-アデニル酸(R)-2,4-ジヒドロキシ-3,3-ジメチルブチリル
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: C16H24N5O10P
Molecular formula furigana: C16-H24-N5-O10-P
Molecular weight: 477.367
InChI: InChI=1S/C16H24N5O10P/c1-16(2,4-22)11(25)15(26)31-32(27,28)29-3-7-9(23)10(24)14(30-7)21-6-20-8-12(17)18-5-19-13(8)21/h5-7,9-11,14,22-25H,3-4H2,1-2H3,(H,27,28)(H2,17,18,19)/t7-,9-,10-,11+,14-/m1/s1
InChI key: GDPVENOGSVMRJL-FSRKKXLISA-N
SMILES: CC(C)(CO)[C@@H](O)C(=O)OP(=O)(O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
Systematic name  (3):
  • 5′-アデニル酸(R)-2,4-ジヒドロキシ-3,3-ジメチルブチリル
  • {[(2R,3S,4R,5R)-5-(6-アミノ-9H-プリン-9-イル)-3,4-ジヒドロキシオキソラン-2-イル]メトキシ}({[(2R)-2,4-ジヒドロキシ-3,3-ジメチルブタノイル]オキシ})ホスフィン酸
  • {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]oxy})phosphinic acid
Other name (1):
  • 5′-Adenylic acid (R)-2,4-dihydroxy-3,3-dimethylbutyryl ester
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