(Q104952796)

English

2-hydroxy-5-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoic acid

group of stereoisomers with the chemical formula C₁₃H₁₆O₉

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Statements

group of stereoisomers

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chemical compound

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316.079432092 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₁₃H₁₆O₉

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canonical SMILES

O=C(O)C1=CC(OC2OC(CO)C(O)C(O)C2O)=CC=C1O

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isomeric SMILES

O=C(O)c1cc(OC2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O

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Harpephyllum caffrum

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Constitutive phenolics of Harpephyllum caffrum (Anacardiaceae) and their biological effects on human keratinocytes.

Identifiers

InChI=1S/C13H16O9/c14-4-8-9(16)10(17)11(18)13(22-8)21-5-1-2-7(15)6(3-5)12(19)20/h1-3,8-11,13-18H,4H2,(H,19,20)/t8-,9-,10+,11-,13?/m1/s1

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CBTFERBMQQAROP-TWEVDUBQSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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