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
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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:
C16 H24 N5 O10 P
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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