(Q111263061)

English

3-[(4,5-dihydroxy-6-{[7-hydroxy-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-3-{[3,4,5-trihydroxy-6-({[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}chromen-5-yl]oxy}-2-(hydroxymethyl)oxan-3-yl)oxy]-3-oxopropanoic acid

group of stereoisomers with the chemical formula C₃₉H₃₈O₂₀

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

826.195643616 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₉H₃₈O₂₀

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canonical SMILES

O=C(O)CC(=O)OC1C(O)C(O)C(OC=2C=C(O)C=C3OC(C(OC4OC(COC(=O)C=CC5=CC=C(O)C=C5)C(O)C(O)C4O)=CC32)=C6C=CC(=O)C=C6)OC1CO

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found in taxon

Hyacinthus orientalis

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stated in

Acylated anthocyanins from red Hyacinthus orientalis

Identifiers

InChI

InChI=1S/C39H38O20/c40-15-26-37(59-30(47)14-28(44)45)33(50)35(52)39(57-26)55-24-12-21(43)11-23-22(24)13-25(36(54-23)18-4-8-20(42)9-5-18)56-38-34(51)32(49)31(48)27(58-38)16-53-29(46)10-3-17-1-6-19(41)7-2-17/h1-13,26-27,31-35,37-41,43,48-52H,14-16H2,(H,44,45)

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InChIKey

LEACSFZGVZBSAF-UHFFFAOYSA-N

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(Q111263061)

3-[(4,5-dihydroxy-6-{[7-hydroxy-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-3-{[3,4,5-trihydroxy-6-({[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}chromen-5-yl]oxy}-2-(hydroxymethyl)oxan-3-yl)oxy]-3-oxopropanoic acid

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Identifiers

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