(Q110204486)

English

1-Benzopyrylium, 2-(3,4-dihydroxyphenyl)-3-[[6-O-beta-D-glucopyranosyl-4-O-[3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranosyl]oxy]-5,7-dihydroxy-

group of stereoisomers with the chemical formula C₃₈H₄₁O₂₀⁺

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instance of

group of stereoisomers

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subclass of

organic cation

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mass

817.21857013209 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₈H₄₁O₂₀⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

O=C(OC1C(O)C(O)C(OC2=CC=3C(O)=CC(O)=CC3[O+]=C2C=4C=CC(O)=C(O)C4)OC1COC5OC(CO)C(O)C(O)C5O)C=CC6=CC(OC)=C(O)C(OC)=C6

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found in taxon

Dioscorea alata

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stated in

Two acylated anthocyanins from Dioscorea alata

Identifiers

InChI

InChI=1S/C38H40O20/c1-51-23-7-15(8-24(52-2)29(23)45)3-6-28(44)58-36-27(14-53-37-33(49)31(47)30(46)26(13-39)56-37)57-38(34(50)32(36)48)55-25-12-18-20(42)10-17(40)11-22(18)54-35(25)16-4-5-19(41)21(43)9-16/h3-12,26-27,30-34,36-39,46-50H,13-14H2,1-2H3,(H4-,40,41,42,43,44,45)/p+1

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InChIKey

RAPZMNBUKQLWKN-UHFFFAOYSA-O

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CAS Registry Number

131189-50-9

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stated in

CAS (formerly Chemical Abstracts Service)

25 January 2022

1 reference

17 September 2022

inferred from InChIKey

1 reference

17 September 2022

inferred from InChIKey

(Q110204486)

1-Benzopyrylium, 2-(3,4-dihydroxyphenyl)-3-[[6-O-beta-D-glucopyranosyl-4-O-[3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranosyl]oxy]-5,7-dihydroxy-

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Identifiers

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