Chem
J-GLOBAL ID:200907015632153535   Nikkaji number:J2.093.245G

2-[4-(Methoxymethoxy)phenyl]-6,7-(1-deoxy-β-D-glucopyranose-1,2-O-diyl)-4H-1-benzopyran-4-one

2-[4-(メトキシメトキシ)フェニル]-6,7-(1-デオキシ-β-D-グルコピラノース-1,2-O-ジイル)-4H-1-ベンゾピラン-4-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: C23H22O9
Molecular formula furigana: C23-H22-O9
Molecular weight: 442.420
InChI: InChI=1S/C23H22O9/c1-28-10-29-12-4-2-11(3-5-12)16-7-15(25)13-6-14-18(8-17(13)30-16)31-23-21(27)20(26)19(9-24)32-22(14)23/h2-8,19-24,26-27H,9-10H2,1H3/t19-,20-,21+,22+,23-/m1/s1
InChI key: IUNHWALZJIODLG-MHMIHQHRSA-N
SMILES: COCOc1ccc(cc1)c1cc(=O)c2cc3[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4Oc3cc2o1
Systematic name  (3):
  • 2-[4-(メトキシメトキシ)フェニル]-6,7-(1-デオキシ-β-D-グルコピラノース-1,2-O-ジイル)-4H-1-ベンゾピラン-4-オン
  • (11S,13R,14S,15S,16R)-14,15-ジヒドロキシ-13-(ヒドロキシメチル)-5-[4-(メトキシメトキシ)フェニル]-4,12,17-トリオキサテトラシクロ[8.7.0.03,8.011,16]ヘプタデカ-1(10),2,5,8-テトラエン-7-オン
  • (11S,13R,14S,15S,16R)-14,15-dihydroxy-13-(hydroxymethyl)-5-[4-(methoxymethoxy)phenyl]-4,12,17-trioxatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),2,5,8-tetraen-7-one
Other name (1):
  • 2-[4-(Methoxymethoxy)phenyl]-6,7-(1-deoxy-β-D-glucopyranose-1,2-O-diyl)-4H-1-benzopyran-4-one
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