Chem
J-GLOBAL ID:200907017375574071   Nikkaji number:J2.538.810K

1-[4-(β-D-Glucopyranosyloxy)phenyl]-2-methyl-3-hydroxypyridine-4(1H)-one

1-[4-(β-D-グルコピラノシルオキシ)フェニル]-2-メチル-3-ヒドロキシピリジン-4(1H)-オン
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: C18H21NO8
Molecular formula furigana: C18-H21-N-O8
Molecular weight: 379.365
InChI: InChI=1S/C18H21NO8/c1-9-14(22)12(21)6-7-19(9)10-2-4-11(5-3-10)26-18-17(25)16(24)15(23)13(8-20)27-18/h2-7,13,15-18,20,22-25H,8H2,1H3/t13-,15-,16+,17-,18-/m1/s1
InChI key: LOCTZGKIEHHAAD-SOVHRIKKSA-N
SMILES: Cc1c(O)c(=O)ccn1c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
Systematic name  (3):
  • 1-[4-(β-D-グルコピラノシルオキシ)フェニル]-2-メチル-3-ヒドロキシピリジン-4(1H)-オン
  • 3-ヒドロキシ-2-メチル-1-(4-{[(2S,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}フェニル)-1,4-ジヒドロピリジン-4-オン
  • 3-hydroxy-2-methyl-1-(4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-1,4-dihydropyridin-4-one
Other name (1):
  • 1-[4-(β-D-Glucopyranosyloxy)phenyl]-2-methyl-3-hydroxypyridine-4(1H)-one
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