(Q105228150)

English

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

chemical compound

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instance of

type of chemical entity

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subclass of

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

1 reference

based on heuristic

inferred from SMILES

mass

464.131861588 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₄O₁₁

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canonical SMILES

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

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isomeric SMILES

COc1ccc(/C=C/C(=O)c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c2O)cc1O

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found in taxon

Bidens campylotheca

1 reference

stated in

Chalcone glycosides from Bidens campylotheca

Bidens torta

1 reference

stated in

Methylated Chalcones from Bidens torta

Identifiers

InChI

InChI=1S/C22H24O11/c1-31-14-6-3-10(8-13(14)25)2-5-12(24)11-4-7-15(18(27)17(11)26)32-22-21(30)20(29)19(28)16(9-23)33-22/h2-8,16,19-23,25-30H,9H2,1H3/b5-2+/t16-,19-,20+,21-,22-/m1/s1

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InChIKey

QUGFZLLBKBSAGW-CVOAYDCWSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QUGFZLLBKBSAGW-CVOAYDCWSA-N

(Q105228150)

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

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