Chem
J-GLOBAL ID：200907027224900851   Nikkaji number：J2.499.801K

7-Benzyl-7-azoniaguanosine 5′-phosphoric acid

7-ベンジル-7-アゾニアグアノシン5′-りん酸
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： C17H21N4[N+]O8P
Molecular formula furigana： C17-H21-N5-O8-P
Molecular weight： 454.355
InChI： InChI=1S/C17H20N5O8P/c18-17-19-14-11(15(25)20-17)21(6-9-4-2-1-3-5-9)8-22(14)16-13(24)12(23)10(30-16)7-29-31(26,27)28/h1-5,8,10,12-13,16,23-24H,6-7H2,(H4-,18,19,20,25,26,27,28)/p+1/t10-,12-,13-,16-/m1/s1
InChI key： WMKJRKYLDWLLPS-XNIJJKJLSA-O
SMILES： Nc1nc2n(c[n+](Cc3ccccc3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O
Systematic name  (3)：
  • 7-ベンジル-7-アゾニアグアノシン5′-りん酸
  • 2-アミノ-7-ベンジル-9-[(2R,3R,4S,5R)-3,4-ジヒドロキシ-5-[(ホスホノオキシ)メチル]オキソラン-2-イル]-6-オキソ-6,9-ジヒドロ-1H-プリン-7-イウム
  • 2-amino-7-benzyl-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl]-6-oxo-6,9-dihydro-1H-purin-7-ium
Other name (1)：
  • 7-Benzyl-7-azoniaguanosine 5′-phosphoric acid
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