(Q105031029)

English

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

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

3'C-substituted chalcone

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3'C-prenylchalcone

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mass

486.18898254 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

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

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₆H₃₀O₉

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canonical SMILES

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

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isomeric SMILES

CC(C)=CCc1c(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc(C(=O)/C=C/c2ccc(O)cc2)c1O

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found in taxon

Maclura tinctoria

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stated in

Antioxidant chalcone glycosides and flavanones from Maclura (Chlorophora) tinctoria

Identifiers

InChI

InChI=1S/C26H30O9/c1-14(2)3-9-18-20(34-26-25(33)24(32)23(31)21(13-27)35-26)12-10-17(22(18)30)19(29)11-6-15-4-7-16(28)8-5-15/h3-8,10-12,21,23-28,30-33H,9,13H2,1-2H3/b11-6+/t21-,23+,24-,25+,26+/m0/s1

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InChIKey

HNRQFWQDRYQVNP-HSBBMYPDSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HNRQFWQDRYQVNP-HSBBMYPDSA-N

(Q105031029)

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

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Identifiers

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