(Q105227066)

English

[(2S,4S,5R)-2-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] hydrogen sulfate

group of stereoisomers with the chemical formula C₂₁H₂₀O₁₄S

In more languages

Statements

group of stereoisomers

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1 reference

528.05737632 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₀O₁₄S

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canonical SMILES

O=C1C(OC2OC(CO)C(O)C(O)C2OS(=O)(=O)O)=C(OC=3C=C(O)C=C(O)C13)C=4C=CC(O)=CC4

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isomeric SMILES

O=c1c(O[C@@H]2OC(CO)[C@H](O)[C@H](O)C2OS(=O)(=O)O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12

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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/C21H20O14S/c22-7-13-15(26)17(28)20(35-36(29,30)31)21(33-13)34-19-16(27)14-11(25)5-10(24)6-12(14)32-18(19)8-1-3-9(23)4-2-8/h1-6,13,15,17,20-26,28H,7H2,(H,29,30,31)/t13?,15-,17-,20?,21-/m0/s1

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QSKHZWPEBFUWQZ-JWINJSAJSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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