Chem
J-GLOBAL ID:200907083626387597
Nikkaji number:J2.254.189G
2α-(3,4-Dihydroxyphenyl)-8-(β-D-glucopyranosyl)-3,4-dihydro-2H-1-benzopyran-3α,5,7-triol
2α-(3,4-ジヒドロキシフェニル)-8-(β-D-グルコピラノシル)-3,4-ジヒドロ-2H-1-ベンゾピラン-3α,5,7-トリオール
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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 H24 O11
Molecular formula furigana:
C21-H24-O11
Molecular weight:
452.412
InChI:
InChI=1S/C21H24O11/c22-6-14-16(28)17(29)18(30)21(31-14)15-12(26)5-10(24)8-4-13(27)19(32-20(8)15)7-1-2-9(23)11(25)3-7/h1-3,5,13-14,16-19,21-30H,4,6H2/t13-,14-,16-,17+,18-,19-,21+/m1/s1
InChI key:
XWDHVYPMZCGHNM-SBNMIOBJSA-N
SMILES:
OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1c(O)cc(O)c2C[C@@H](O)[C@H](Oc12)c1ccc(O)c(O)c1
Systematic name (5):
(2R)-8-β-D-グルコピラノシル-2α-(3,4-ジヒドロキシフェニル)-3,4-ジヒドロ-2H-1-ベンゾピラン-3α,5,7-トリオール
2α-(3,4-ジヒドロキシフェニル)-3α,5,7-トリヒドロキシ-8-(β-D-グルコピラノシル)-3,4-ジヒドロ-2H-1-ベンゾピラン
2α-(3,4-ジヒドロキシフェニル)-8-(β-D-グルコピラノシル)-3,4-ジヒドロ-2H-1-ベンゾピラン-3α,5,7-トリオール
(2R,3R)-2-(3,4-ジヒドロキシフェニル)-8-[(2S,3R,4R,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]-3,4-ジヒドロ-2H-1-ベンゾピラン-3,5,7-トリオール
(2R,3R)-2-(3,4-dihydroxyphenyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,4-dihydro-2H-1-benzopyran-3,5,7-triol
Other name (3):
(2R)-8-β-D-Glucopyranosyl-2α-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3α,5,7-triol
2α-(3,4-Dihydroxyphenyl)-3α,5,7-trihydroxy-8-(β-D-glucopyranosyl)-3,4-dihydro-2H-1-benzopyran
2α-(3,4-Dihydroxyphenyl)-8-(β-D-glucopyranosyl)-3,4-dihydro-2H-1-benzopyran-3α,5,7-triol
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