Chem
J-GLOBAL ID:201007047212416212   Nikkaji number:J2.799.558F

1-(β-D-Ribofuranosyl)-2,4-dioxo-6,7-bis(4-bromophenyl)-1,2,3,4-tetrahydropteridine-3-butyric acid ethyl ester

1-(β-D-リボフラノシル)-2,4-ジオキソ-6,7-ビス(4-ブロモフェニル)-1,2,3,4-テトラヒドロプテリジン-3-酪酸エチル
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: C29H28Br2N4O8
Molecular formula furigana: C29-H28-BR2-N4-O8
Molecular weight: 720.371
InChI: InChI=1S/C29H28Br2N4O8/c1-2-42-20(37)4-3-13-34-27(40)23-26(35(29(34)41)28-25(39)24(38)19(14-36)43-28)33-22(16-7-11-18(31)12-8-16)21(32-23)15-5-9-17(30)10-6-15/h5-12,19,24-25,28,36,38-39H,2-4,13-14H2,1H3/t19-,24-,25-,28-/m1/s1
InChI key: BSTBPBQPIGUKQG-BESFBVRISA-N
SMILES: CCOC(=O)CCCn1c(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c2nc(c3ccc(Br)cc3)c(nc2c1=O)c1ccc(Br)cc1
Systematic name  (3):
  • 1-(β-D-リボフラノシル)-2,4-ジオキソ-6,7-ビス(4-ブロモフェニル)-1,2,3,4-テトラヒドロプテリジン-3-酪酸エチル
  • エチル 4-[6,7-ビス(4-ブロモフェニル)-1-[(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]-2,4-ジオキソ-1,2,3,4-テトラヒドロプテリジン-3-イル]ブタノアート
  • ethyl 4-[6,7-bis(4-bromophenyl)-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxo-1,2,3,4-tetrahydropteridin-3-yl]butanoate
Other name (1):
  • 1-(β-D-Ribofuranosyl)-2,4-dioxo-6,7-bis(4-bromophenyl)-1,2,3,4-tetrahydropteridine-3-butyric acid ethyl ester
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