Chem
J-GLOBAL ID：200907082785957357   Nikkaji number：J2.287.937E

β-(β-D-Glucopyranosyloxy)-3′-methoxy-4′-hydroxypropiophenone

β-(β-D-グルコピラノシルオキシ)-3′-メトキシ-4′-ヒドロキシプロピオフェノン
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： C16H22O9
Molecular formula furigana： C16-H22-O9
Molecular weight： 358.343
InChI： InChI=1S/C16H22O9/c1-23-11-6-8(2-3-10(11)19)9(18)4-5-24-16-15(22)14(21)13(20)12(7-17)25-16/h2-3,6,12-17,19-22H,4-5,7H2,1H3/t12-,13-,14+,15-,16-/m1/s1
InChI key： YFXJLDCTEUBHCO-IBEHDNSVSA-N
SMILES： COc1cc(ccc1O)C(=O)CCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (4)：
  • 3-(4-ヒドロキシ-3-メトキシフェニル)-3-オキソプロピルβ-D-グルコピラノシド
  • β-(β-D-グルコピラノシルオキシ)-3′-メトキシ-4′-ヒドロキシプロピオフェノン
  • 1-(4-ヒドロキシ-3-メトキシフェニル)-3-{[(2R,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}プロパン-1-オン
  • 1-(4-hydroxy-3-methoxyphenyl)-3-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-1-one
Other name (2)：
  • 3-(4-Hydroxy-3-methoxyphenyl)-3-oxopropyl β-D-glucopyranoside
  • β-(β-D-Glucopyranosyloxy)-3′-methoxy-4′-hydroxypropiophenone
Thsaurus map：
Thesaurus Map

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