Chem
J-GLOBAL ID:201207018228044549   Nikkaji number:J3.009.911G

Megouraphin glucoside B

メゴウラフィングルコシドB
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: C23H24O11
Molecular formula furigana: C23-H24-O11
Molecular weight: 476.434
InChI: InChI=1S/C23H24O11/c1-9(24)3-14-18-12(7-32-14)4-11-5-13(26)6-15(17(11)20(18)28)33-23-22(30)21(29)19(27)16(34-23)8-31-10(2)25/h3-6,16,19,21-23,26-30H,7-8H2,1-2H3/t16-,19-,21+,22-,23-/m1/s1
InChI key: FCPWKSIEMRRIBL-MTHGGYLLSA-N
SMILES: CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)cc3cc4COC(=CC(=O)C)c4c(O)c23)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name  (3):
  • 1-[5-[(6-O-アセチル-β-D-グルコピラノシル)オキシ]-4,7-ジヒドロキシナフト[2,3-c]フラン-3(1H)-イリデン]-2-プロパノン
  • [(2R,3S,4S,5R,6S)-6-{[4,7-ジヒドロキシ-3-(2-オキソプロピリデン)-1H,3H-ナフト[2,3-c]フラン-5-イル]オキシ}-3,4,5-トリヒドロキシオキサン-2-イル]メチル アセタート
  • [(2R,3S,4S,5R,6S)-6-{[4,7-dihydroxy-3-(2-oxopropylidene)-1H,3H-naphtho[2,3-c]furan-5-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl acetate
Other name (3):
  • 1-[5-[(6-O-Acetyl-β-D-glucopyranosyl)oxy]-4,7-dihydroxynaphtho[2,3-c]furan-3(1H)-ylidene]-2-propanone
  • メゴウラフィングルコシドB
  • Megouraphin glucoside B
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