Chem
J-GLOBAL ID:200907058432319766
Nikkaji number:J1.212.662J
3,4-Dihydroxyphenyl 6-O-benzoyl-β-D-glucopyranoside
3,4-ジヒドロキシフェニル6-O-ベンゾイル-β-D-グルコピラノシド
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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:
C19 H20 O9
Molecular formula furigana:
C19-H20-O9
Molecular weight:
392.360
InChI:
InChI=1S/C19H20O9/c20-12-7-6-11(8-13(12)21)27-19-17(24)16(23)15(22)14(28-19)9-26-18(25)10-4-2-1-3-5-10/h1-8,14-17,19-24H,9H2/t14-,15-,16+,17-,19-/m1/s1
InChI key:
NAXRNCZKQQXVIW-OGJJZOIMSA-N
SMILES:
O[C@H]1[C@H](O)[C@@H](COC(=O)c2ccccc2)O[C@@H](Oc2ccc(O)c(O)c2)[C@@H]1O
Systematic name (3):
3,4-ジヒドロキシフェニル6-O-ベンゾイル-β-D-グルコピラノシド
[(2R,3S,4S,5R,6S)-6-(3,4-ジヒドロキシフェノキシ)-3,4,5-トリヒドロキシオキサン-2-イル]メチル ベンゾアート
[(2R,3S,4S,5R,6S)-6-(3,4-dihydroxyphenoxy)-3,4,5-trihydroxyoxan-2-yl]methyl benzoate
Other name (1):
3,4-Dihydroxyphenyl 6-O-benzoyl-β-D-glucopyranoside
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