Chem
J-GLOBAL ID:200907058489079494
Nikkaji number:J1.010.754G
6-[4-[(2,3-Dihydro-3-oxo-4-chloropyridazine)-5-yl]-1-piperazinyl]-9-(β-D-ribofuranosyl)-9H-purine
6-[4-[(2,3-ジヒドロ-3-オキソ-4-クロロピリダジン)-5-イル]-1-ピペラジニル]-9-(β-D-リボフラノシル)-9H-プリン
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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:
C18 H21 ClN8 O5
Molecular formula furigana:
C18-H21-CL-N8-O5
Molecular weight:
464.870
InChI:
InChI=1S/C18H21ClN8O5/c19-11-9(5-23-24-17(11)31)25-1-3-26(4-2-25)15-12-16(21-7-20-15)27(8-22-12)18-14(30)13(29)10(6-28)32-18/h5,7-8,10,13-14,18,28-30H,1-4,6H2,(H,24,31)/t10-,13-,14-,18-/m1/s1
InChI key:
GRHQUNNROKMKSV-OXQGGJHDSA-N
SMILES:
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(ncnc12)N1CCN(CC1)c1cn[nH]c(=O)c1Cl
Systematic name (3):
6-[4-[(2,3-ジヒドロ-3-オキソ-4-クロロピリダジン)-5-イル]-1-ピペラジニル]-9-(β-D-リボフラノシル)-9H-プリン
4-クロロ-5-(4-{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-6-イル}ピペラジン-1-イル)-2,3-ジヒドロピリダジン-3-オン
4-chloro-5-(4-{9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-9H-purin-6-yl}piperazin-1-yl)-2,3-dihydropyridazin-3-one
Other name (1):
6-[4-[(2,3-Dihydro-3-oxo-4-chloropyridazine)-5-yl]-1-piperazinyl]-9-(β-D-ribofuranosyl)-9H-purine
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