Chem
J-GLOBAL ID:200907051317472661
Nikkaji number:J2.032.162H
4-(2-Hydroxyethyl)phenyl 3-O-β-D-glucopyranosyl-α-L-rhamnopyranoside
4-(2-ヒドロキシエチル)フェニル3-O-β-D-グルコピラノシル-α-L-ラムノピラノシド
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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:
C20 H30 O11
Molecular formula furigana:
C20-H30-O11
Molecular weight:
446.449
InChI:
InChI=1S/C20H30O11/c1-9-13(23)18(31-19-16(26)15(25)14(24)12(8-22)30-19)17(27)20(28-9)29-11-4-2-10(3-5-11)6-7-21/h2-5,9,12-27H,6-8H2,1H3/t9-,12+,13-,14+,15-,16+,17+,18+,19-,20-/m0/s1
InChI key:
KAWZZJROBORQGR-LYKPPGFHSA-N
SMILES:
C[C@@H]1O[C@@H](Oc2ccc(CCO)cc2)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O
Systematic name (3):
4-(2-ヒドロキシエチル)フェニル3-O-β-D-グルコピラノシル-α-L-ラムノピラノシド
(2S,3R,4S,5S,6R)-2-{[(2S,3R,4R,5S,6S)-3,5-ジヒドロキシ-2-[4-(2-ヒドロキシエチル)フェノキシ]-6-メチルオキサン-4-イル]オキシ}-6-(ヒドロキシメチル)オキサン-3,4,5-トリオール
(2S,3R,4S,5S,6R)-2-{[(2S,3R,4R,5S,6S)-3,5-dihydroxy-2-[4-(2-hydroxyethyl)phenoxy]-6-methyloxan-4-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Other name (1):
4-(2-Hydroxyethyl)phenyl 3-O-β-D-glucopyranosyl-α-L-rhamnopyranoside
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