Chem
J-GLOBAL ID:200907024632121993   Nikkaji number:J2.279.370E

3′-O,5′-O-[2-Oxo-7-[bis(tert-butoxycarbonylmethyl)amino]-2H-1-benzopyran-4-ylmethoxyphosphinylidene]-8-bromoguanosine

3′-O,5′-O-[2-オキソ-7-[ビス(tert-ブトキシカルボニルメチル)アミノ]-2H-1-ベンゾピラン-4-イルメトキシホスフィニリデン]-8-ブロモグアノシン
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: C32H38BrN6O13P
Molecular formula furigana: C32-H38-BR-N6-O13-P
Molecular weight: 825.563
InChI: InChI=1S/C32H38BrN6O13P/c1-31(2,3)50-21(41)11-38(12-22(42)51-32(4,5)6)16-7-8-17-15(9-20(40)48-18(17)10-16)13-46-53(45)47-14-19-25(52-53)24(43)28(49-19)39-26-23(35-29(39)33)27(44)37-30(34)36-26/h7-10,19,24-25,28,43H,11-14H2,1-6H3,(H3,34,36,37,44)/t19-,24-,25-,28-,53?/m1/s1
InChI key: JQMDPBVFIKIADO-DTDCUOEESA-N
SMILES: CC(C)(C)OC(=O)CN(CC(=O)OC(C)(C)C)c1ccc2c(COP3(=O)OC[C@H]4O[C@H]([C@H](O)[C@@H]4O3)n3c(Br)nc4c3nc(N)[nH]c4=O)cc(=O)oc2c1
Systematic name  (3):
  • 3′-O,5′-O-[2-オキソ-7-[ビス(tert-ブトキシカルボニルメチル)アミノ]-2H-1-ベンゾピラン-4-イルメトキシホスフィニリデン]-8-ブロモグアノシン
  • tert-ブチル 2-{[4-({[(4aR,6R,7R,7aS)-6-(2-アミノ-8-ブロモ-6-オキソ-6,9-ジヒドロ-1H-プリン-9-イル)-7-ヒドロキシ-2-オキソ-ヘキサヒドロ-2λ5-フロ[3,2-d][1,3,2]ジオキサホスフィニン-2-イル]オキシ}メチル)-2-オキソ-2H-クロメン-7-イル][2-(tert-ブトキシ)-2-オキソエチル]アミノ}アセタート
  • tert-butyl 2-{[4-({[(4aR,6R,7R,7aS)-6-(2-amino-8-bromo-6-oxo-6,9-dihydro-1H-purin-9-yl)-7-hydroxy-2-oxo-hexahydro-2λ5-furo[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy}methyl)-2-oxo-2H-chromen-7-yl][2-(tert-butoxy)-2-oxoethyl]amino}acetate
Other name (1):
  • 3′-O,5′-O-[2-Oxo-7-[bis(tert-butoxycarbonylmethyl)amino]-2H-1-benzopyran-4-ylmethoxyphosphinylidene]-8-bromoguanosine
Thsaurus map:

Return to Previous Page