Chem
J-GLOBAL ID:200907048757298050   Nikkaji number:J1.032.397E

2-Bromo-2′-O-[2-bromo-2′-O-(2-bromo-5′-adenylyl)-5′-adenylyl]-5′-adenylic acid

2-ブロモ-2′-O-[2-ブロモ-2′-O-(2-ブロモ-5′-アデニリル)-5′-アデニリル]-5′-アデニル酸
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: C30H35Br3N15O19P3
Molecular formula furigana: C30-H35-BR3-N15-O19-P3
Molecular weight: 1242.329
InChI: InChI=1S/C30H35Br3N15O19P3/c31-28-40-19(34)10-22(43-28)46(4-37-10)25-16(52)13(49)7(63-25)2-61-69(56,57)67-18-15(51)9(65-27(18)48-6-39-12-21(36)42-30(33)45-24(12)48)3-62-70(58,59)66-17-14(50)8(1-60-68(53,54)55)64-26(17)47-5-38-11-20(35)41-29(32)44-23(11)47/h4-9,13-18,25-27,49-52H,1-3H2,(H,56,57)(H,58,59)(H2,34,40,43)(H2,35,41,44)(H2,36,42,45)(H2,53,54,55)/t7-,8-,9-,13-,14-,15-,16-,17-,18-,25-,26-,27-/m1/s1
InChI key: GRCOXYGJMOBYHS-FJVAVWNESA-N
SMILES: Nc1nc(Br)nc2n(cnc12)[C@@H]1O[C@H](COP(=O)(O)O[C@@H]2[C@H](O)[C@@H](COP(=O)(O)O[C@@H]3[C@H](O)[C@@H](COP(=O)(O)O)O[C@H]3n3cnc4c(N)nc(Br)nc34)O[C@H]2n2cnc3c(N)nc(Br)nc23)[C@@H](O)[C@H]1O
Systematic name  (3):
  • 2-ブロモ-2′-O-[2-ブロモ-2′-O-(2-ブロモ-5′-アデニリル)-5′-アデニリル]-5′-アデニル酸
  • {[(2R,3R,4R,5R)-5-(6-アミノ-2-ブロモ-9H-プリン-9-イル)-4-[({[(2R,3R,4R,5R)-5-(6-アミノ-2-ブロモ-9H-プリン-9-イル)-4-[({[(2R,3S,4R,5R)-5-(6-アミノ-2-ブロモ-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}(ヒドロキシ)ホスホリル)オキシ]-3-ヒドロキシオキソラン-2-イル]メトキシ}(ヒドロキシ)ホスホリル)オキシ]-3-ヒドロキシオキソラン-2-イル]メトキシ}ホスホン酸
  • {[(2R,3R,4R,5R)-5-(6-amino-2-bromo-9H-purin-9-yl)-4-[({[(2R,3R,4R,5R)-5-(6-amino-2-bromo-9H-purin-9-yl)-4-[({[(2R,3S,4R,5R)-5-(6-amino-2-bromo-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]-3-hydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]-3-hydroxyoxolan-2-yl]methoxy}phosphonic acid
Other name (1):
  • 2-Bromo-2′-O-[2-bromo-2′-O-(2-bromo-5′-adenylyl)-5′-adenylyl]-5′-adenylic acid
Thsaurus map:

Return to Previous Page