Chem
J-GLOBAL ID:200907035193391379   Nikkaji number:J2.532.327K

2-Amino-9-[(1R,2R)-1-(phosphonomethoxymethyl)-2-hydroxy-3-(phosphonomethoxy)propyl]-9H-purine-6-ol

2-アミノ-9-[(1R,2R)-1-(ホスホノメトキシメチル)-2-ヒドロキシ-3-(ホスホノメトキシ)プロピル]-9H-プリン-6-オール
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: C11H19N5O10P2
Molecular formula furigana: C11-H19-N5-O10-P2
Molecular weight: 443.246
InChI: InChI=1S/C11H19N5O10P2/c12-11-14-9-8(10(18)15-11)13-3-16(9)6(1-25-4-27(19,20)21)7(17)2-26-5-28(22,23)24/h3,6-7,17H,1-2,4-5H2,(H2,19,20,21)(H2,22,23,24)(H3,12,14,15,18)/t6-,7+/m1/s1
InChI key: IQFPBPNYBQCFLP-RQJHMYQMSA-N
SMILES: Nc1nc(O)c2ncn([C@H](COCP(=O)(O)O)[C@@H](O)COCP(=O)(O)O)c2n1
Systematic name  (3):
  • 2-アミノ-9-[(1R,2R)-1-(ホスホノメトキシメチル)-2-ヒドロキシ-3-(ホスホノメトキシ)プロピル]-9H-プリン-6-オール
  • {[(2R,3R)-3-(2-アミノ-6-ヒドロキシ-9H-プリン-9-イル)-2-ヒドロキシ-4-(ホスホノメトキシ)ブトキシ]メチル}ホスホン酸
  • {[(2R,3R)-3-(2-amino-6-hydroxy-9H-purin-9-yl)-2-hydroxy-4-(phosphonomethoxy)butoxy]methyl}phosphonic acid
Other name (1):
  • 2-Amino-9-[(1R,2R)-1-(phosphonomethoxymethyl)-2-hydroxy-3-(phosphonomethoxy)propyl]-9H-purine-6-ol
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