(Q104958624)

English

[2-(Acetyloxymethyl)-5-[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-6-[2-(3,4-dihydroxyphenyl)ethoxy]-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-3-yl] 3-(3,4-dihydroxyphenyl)prop-2-enoate

group of stereoisomers with the chemical formula C₃₆H₄₆O₂₀

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group of stereoisomers

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798.258243872 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₆H₄₆O₂₀

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canonical SMILES

O=C(OC1C(OC(OCCC2=CC=C(O)C(O)=C2)C(OC3OCC(O)(CO)C3O)C1OC4OC(C)C(O)C(O)C4O)COC(=O)C)C=CC5=CC=C(O)C(O)=C5

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Identifiers

InChI

InChI=1S/C36H46O20/c1-16-26(44)27(45)28(46)33(52-16)55-30-29(54-25(43)8-5-18-3-6-20(39)22(41)11-18)24(13-50-17(2)38)53-34(49-10-9-19-4-7-21(40)23(42)12-19)31(30)56-35-32(47)36(48,14-37)15-51-35/h3-8,11-12,16,24,26-35,37,39-42,44-48H,9-10,13-15H2,1-2H3

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InChIKey

CHCBSUXEBKZFGJ-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

CHCBSUXEBKZFGJ-UHFFFAOYSA-N

(Q104958624)

[2-(Acetyloxymethyl)-5-[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-6-[2-(3,4-dihydroxyphenyl)ethoxy]-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-3-yl] 3-(3,4-dihydroxyphenyl)prop-2-enoate

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