Chem
J-GLOBAL ID:200907076080896618
Nikkaji number:J2.738.173A
Everiastoside H
エベリアストシドH
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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:
C21 H28 O14
Molecular formula furigana:
C21-H28-O14
Molecular weight:
504.441
InChI:
InChI=1S/C21H28O14/c1-30-8-2-7-5-31-19(29)12(7)9(3-8)33-21-18(28)16(26)14(24)11(35-21)6-32-20-17(27)15(25)13(23)10(4-22)34-20/h2-3,10-11,13-18,20-28H,4-6H2,1H3/t10-,11-,13-,14-,15+,16+,17-,18-,20-,21-/m1/s1
InChI key:
YJWWEQARGMFMKC-PLTSEJJTSA-N
SMILES:
COc1cc2COC(=O)c2c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c1
Systematic name (3):
3-オキソ-6-メトキシ-1,3-ジヒドロイソベンゾフラン-4-イル6-O-β-D-グルコピラノシル-β-D-グルコピラノシド
5-メトキシ-7-{[(2S,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-({[(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}メチル)オキサン-2-イル]オキシ}-1,3-ジヒドロ-2-ベンゾフラン-1-オン
5-methoxy-7-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1,3-dihydro-2-benzofuran-1-one
Other name (3):
3-Oxo-6-methoxy-1,3-dihydroisobenzofuran-4-yl 6-O-β-D-glucopyranosyl-β-D-glucopyranoside
エベリアストシドH
Everiastoside H
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