Chem
J-GLOBAL ID：200907066639013589   Nikkaji number：J601.111J

8-(Diethylamino)-8-demethylriboflavin

8-(ジエチルアミノ)-8-デメチルリボフラビン
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： C20H27N5O6
Molecular formula furigana： C20-H27-N5-O6
Molecular weight： 433.465
InChI： InChI=1S/C20H27N5O6/c1-4-24(5-2)12-7-13-11(6-10(12)3)21-16-18(22-20(31)23-19(16)30)25(13)8-14(27)17(29)15(28)9-26/h6-7,14-15,17,26-29H,4-5,8-9H2,1-3H3,(H,23,30,31)/t14-,15+,17-/m0/s1
InChI key： IURAVPSAQYHFSX-UXLLHSPISA-N
SMILES： CCN(CC)c1cc2n(C[C@H](O)[C@H](O)[C@H](O)CO)c3nc(=O)[nH]c(=O)c3nc2cc1C
Systematic name  (3)：
  • 8-(ジエチルアミノ)-8-デメチルリボフラビン
  • 8-(ジエチルアミノ)-7-メチル-10-[(2S,3S,4R)-2,3,4,5-テトラヒドロキシペンチル]-2H,3H,4H,10H-ベンゾ[g]プテリジン-2,4-ジオン
  • 8-(diethylamino)-7-methyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]-2H,3H,4H,10H-benzo[g]pteridine-2,4-dione
Other name (1)：
  • 8-(Diethylamino)-8-demethylriboflavin
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