Chem
J-GLOBAL ID：201007012580431150   Nikkaji number：J2.886.252K

5′-Adenylic acid 3-(4-hydroxyphenyl)propyl ester

5′-アデニル酸3-(4-ヒドロキシフェニル)プロピル
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： C19H24N5O8P
Molecular formula furigana： C19-H24-N5-O8-P
Molecular weight： 481.402
InChI： InChI=1S/C19H24N5O8P/c20-17-14-18(22-9-21-17)24(10-23-14)19-16(27)15(26)13(32-19)8-31-33(28,29)30-7-1-2-11-3-5-12(25)6-4-11/h3-6,9-10,13,15-16,19,25-27H,1-2,7-8H2,(H,28,29)(H2,20,21,22)/t13-,15-,16-,19-/m1/s1
InChI key： AWKHKUUJFJBBRQ-NVQRDWNXSA-N
SMILES： Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(=O)(O)OCCCc2ccc(O)cc2)[C@@H](O)[C@H]1O
Systematic name  (3)：
  • 5′-アデニル酸3-(4-ヒドロキシフェニル)プロピル
  • {[(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}[3-(4-ヒドロキシフェニル)プロポキシ]ホスフィン酸
  • {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}[3-(4-hydroxyphenyl)propoxy]phosphinic acid
Other name (1)：
  • 5′-Adenylic acid 3-(4-hydroxyphenyl)propyl ester
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