Chem
J-GLOBAL ID:200907092647579312
Nikkaji number:J522.428D
2-[2-[4-(2-Carboxyethyl)benzylidene]hydrazino]adenosine
2-[2-[4-(2-カルボキシエチル)ベンジリデン]ヒドラジノ]アデノシン
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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:
C20 H23 N7 O6
Molecular formula furigana:
C20-H23-N7-O6
Molecular weight:
457.447
InChI:
InChI=1S/C20H23N7O6/c21-17-14-18(27(9-22-14)19-16(32)15(31)12(8-28)33-19)25-20(24-17)26-23-7-11-3-1-10(2-4-11)5-6-13(29)30/h1-4,7,9,12,15-16,19,28,31-32H,5-6,8H2,(H,29,30)(H3,21,24,25,26)/t12-,15-,16-,19-/m1/s1
InChI key:
RMOLMLSFQKBAFR-BGIGGGFGSA-N
SMILES:
Nc1nc(NN=Cc2ccc(CCC(=O)O)cc2)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
Systematic name (3):
2-[2-[4-(2-カルボキシエチル)ベンジリデン]ヒドラジノ]アデノシン
3-{4-[(2-{6-アミノ-9-[(2R,3R,4S,5R)-3,4-ジヒドロキシ-5-(ヒドロキシメチル)オキソラン-2-イル]-9H-プリン-2-イル}ヒドラジン-1-イリデン)メチル]フェニル}プロパン酸
3-{4-[(2-{6-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-9H-purin-2-yl}hydrazin-1-ylidene)methyl]phenyl}propanoic acid
Other name (1):
2-[2-[4-(2-Carboxyethyl)benzylidene]hydrazino]adenosine
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