(Q104989147)

English

(2S,3S,4R,5S,6S)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

chemical compound

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type of chemical entity

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1 reference

1 reference

(2S,3S,4S,5R)-6-{[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

1 reference

based on heuristic

inferred from SMILES

mass

478.074740636 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

(2R,3R,4R,5S,6S)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

Quercetin 3-O-beta-D-galacturonopyranoside

1 reference

based on heuristic

inferred from InChI

3',4',5,7-Tetrahydroxyflavon-3-yl alpha-D-glucopyranosiduronic acid

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₁H₁₈O₁₃

0 references

canonical SMILES

O=C(O)C1OC(OC=2C(=O)C=3C(O)=CC(O)=CC3OC2C=4C=CC(O)=C(O)C4)C(O)C(O)C1O

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isomeric SMILES

O=C(O)[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)[C@H](O)[C@@H]1O

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found in taxon

Campanula glomerata

1 reference

stated in

Natural acetylenes. Part XXIX. Polyacetylenes from the Campanulaceae plant family. Tetrahydropyranyl polyacetylenic alcohols from the clustered bellflower (Campanula glomerata L.)

Fuchsia fulgens

1 reference

stated in

Leaf flavonoid and other phenolic glycosides as indicators of parentage in six ornamental Fuchsia species and their hybrids

Hypericum perforatum

1 reference

stated in

Identification of the major constituents of Hypericum perforatum by LC/SPE/NMR and/or LC/MS.

Salvia blepharophylla

1 reference

stated in

Polyphenolics of Salvia--a review

Theobroma grandiflorum

1 reference

stated in

New bioactive polyphenols from Theobroma grandiflorum ("cupuaçu").

Psidium guajava

1 reference

stated in

Cytotoxic phenylethanol glycosides from Psidium guaijava seeds.

Phaseolus vulgaris

2 references

stated in

Composition and Content of Flavonol Glycosides in Green Beans and Their Fate during Processing

stated in

Antioxidant properties of flavonol glycosides from green beans

Sarcandra glabra

1 reference

stated in

Chemical profiling of bioactive constituents in Sarcandra glabra and its preparations using ultra-high-pressure liquid chromatography coupled with LTQ Orbitrap mass spectrometry

Chamaemelum nobile

1 reference

stated in

Nutrients, phytochemicals and bioactivity of wild Roman chamomile: a comparison between the herb and its preparations

Rosa multiflora

1 reference

stated in

Phytochemical characterization of Rosa multiflora Thunb. (Rosaceae) in Japan and South Korea, with a focus on the bioactive flavonol glycoside 'multiflorin A'

Persicaria hydropiper

1 reference

stated in

Antioxidant flavonoids from leaves of Polygonum hydropiper L.

Identifiers

InChI

InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15+,16+,19+,21-/m1/s1

0 references

InChIKey

DUBCCGAQYVUYEU-VFKUPZNOSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q104989147)

(2S,3S,4R,5S,6S)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

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