(Q105352235)

English

7-hydroxy-6,13-dimethoxy-14-[(2R,3S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione

group of stereoisomers with the chemical formula C₂₂H₂₀O₁₃

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

492.0903907 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₀O₁₃

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canonical SMILES

O=C1OC2=C(O)C(OC)=CC=3C(=O)OC=4C(OC5OC(CO)C(O)C(O)C5O)=C(OC)C=C1C4C23

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isomeric SMILES

COc1cc2c(=O)oc3c(O[C@H]4OC(CO)[C@@H](O)C(O)[C@@H]4O)c(OC)cc4c(=O)oc(c1O)c2c34

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found in taxon

Harpephyllum caffrum

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stated in

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

Identifiers

InChI

InChI=1S/C22H20O13/c1-30-8-3-6-11-12-7(20(28)33-18(11)14(8)25)4-9(31-2)17(19(12)34-21(6)29)35-22-16(27)15(26)13(24)10(5-23)32-22/h3-4,10,13,15-16,22-27H,5H2,1-2H3/t10?,13-,15?,16+,22-/m1/s1

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InChIKey

YQIVRYWOBFTREV-YIUDYMISSA-N

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1 reference

17 September 2022

inferred from InChIKey

(Q105352235)

7-hydroxy-6,13-dimethoxy-14-[(2R,3S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione

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Identifiers

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