(Q105152425)

English

(E)-3-(4-hydroxy-3-methoxyphenyl)-1-[2-hydroxy-3-methoxy-4-[(2S,3R,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-en-1-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

chalcone

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mass

478.147511652 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

2',4',4-Trihydroxy-3',3-dimethoxychalcone 4'-O-glucoside

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₃H₂₆O₁₁

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canonical SMILES

O=C(C=CC1=CC=C(O)C(OC)=C1)C2=CC=C(OC3OC(CO)C(O)C(O)C3O)C(OC)=C2O

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isomeric SMILES

COc1cc(/C=C/C(=O)c2ccc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2O)ccc1O

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found in taxon

Wedelia asperrima

1 reference

stated in

A diterpenoid sulphate and flavonoids from wedelia asperrima

Identifiers

InChI

InChI=1S/C23H26O11/c1-31-16-9-11(4-7-14(16)26)3-6-13(25)12-5-8-15(22(32-2)18(12)27)33-23-21(30)20(29)19(28)17(10-24)34-23/h3-9,17,19-21,23-24,26-30H,10H2,1-2H3/b6-3+/t17-,19+,20-,21+,23+/m0/s1

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InChIKey

LIYUMMBCLLSJKG-GZVBZVIASA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LIYUMMBCLLSJKG-GZVBZVIASA-N

(Q105152425)

(E)-3-(4-hydroxy-3-methoxyphenyl)-1-[2-hydroxy-3-methoxy-4-[(2S,3R,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-en-1-one

Statements

Identifiers

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