(Q105325199)

English

(2S,3S,4S,5R)-3,4,5-trihydroxy-6-[5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxyoxane-2-carboxylic acid

group of stereoisomers with the chemical formula C₂₂H₂₀O₁₂

In more languages

Statements

group of stereoisomers

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1 reference

476.09547608 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₀O₁₂

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canonical SMILES

O=C(O)C1OC(OC2=CC(O)=C3C(=O)C=C(OC3=C2)C=4C=CC(OC)=C(O)C4)C(O)C(O)C1O

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isomeric SMILES

COc1ccc(-c2cc(=O)c3c(O)cc(OC4O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O

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Marrubium vulgare

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Compositional analysis and in vivo anti-diabetic activity of wild Algerian Marrubium vulgare L. infusion

Identifiers

InChI=1S/C22H20O12/c1-31-13-3-2-8(4-10(13)23)14-7-12(25)16-11(24)5-9(6-15(16)33-14)32-22-19(28)17(26)18(27)20(34-22)21(29)30/h2-7,17-20,22-24,26-28H,1H3,(H,29,30)/t17-,18-,19+,20-,22?/m0/s1

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XCKMDTYMOHXUHG-QAKXDBDYSA-N

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17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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