(Q103785095)

English

5,7-dihydroxy-2-(3-hydroxy-5-methoxy-4-oxidophenyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1λ⁴-chromen-1-ylium

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

flavylium compound

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mass

478.111126144 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₂O₁₂

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canonical SMILES

[O-]C=1C(O)=CC(=CC1OC)C2=[O+]C=3C=C(O)C=C(O)C3C=C2OC4OC(CO)C(O)C(O)C4O

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isomeric SMILES

COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c1[O-]

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found in taxon

Ribes nigrum

2 references

stated in

Determination of Authenticity of Fruit Jams by HPLC Analysis of Anthocyanins

stated in

Characterization of anthocyanins and proanthocyanidins in some cultivars of Ribes, Aronia, and Sambucus and their antioxidant capacity

Vaccinium angustifolium

2 references

stated in

Determination of Authenticity of Fruit Jams by HPLC Analysis of Anthocyanins

stated in

Quantitation and Distribution of Simple and Acylated Anthocyanins and Other Phenolics in Blueberries

Rubus idaeus

1 reference

stated in

Determination of Authenticity of Fruit Jams by HPLC Analysis of Anthocyanins

Fragaria

1 reference

stated in

Determination of Authenticity of Fruit Jams by HPLC Analysis of Anthocyanins

Prunus avium

1 reference

stated in

Determination of Authenticity of Fruit Jams by HPLC Analysis of Anthocyanins

Vaccinium corymbosum

3 references

stated in

Oxygen radical absorbing capacity of phenolics in blueberries, cranberries, chokeberries, and lingonberries

stated in

Flavonoid glycosides and antioxidant capacity of various blackberry, blueberry and red grape genotypes determined by high-performance liquid chromatography/mass spectrometry

stated in

Quantitation and Distribution of Simple and Acylated Anthocyanins and Other Phenolics in Blueberries

Vaccinium padifolium

1 reference

stated in

Anthocyanins in blue berries of Vaccinium padifolium

bog bilberry

1 reference

stated in

Anthocyanins in Fruits ofVaccinium UhginosumL. (Bog Whortleberry)

Visnea mocanera

1 reference

stated in

Phenolic Composition of the “Mocán” (VisneamocaneraL.f.)

Vitis vinifera

8 references

stated in

Inhibition of rat mammary tumorigenesis by concord grape juice constituents.

stated in

Vitisin A Content in Chilean Wines from Vitis vinifera Cv. Cabernet Sauvignon and Contribution to the Color of Aged Red Wines

stated in

Anthocyanic Composition of Tannat, Cabernet Sauvignon and Merlot Young Red Wines from Uruguay

stated in

Determination of anthocyanins and related components in red wines by micro- and capillary HPLC.

stated in

Determination of major anthocyanin pigments in Hellenic native grape varieties (Vitis vinifera sp.): association with antiradical activity

stated in

Flavonoid glycosides and antioxidant capacity of various blackberry, blueberry and red grape genotypes determined by high-performance liquid chromatography/mass spectrometry

stated in

The Phenolic Composition of South African Pinotage, Shiraz and Cabernet Sauvignon Wines

stated in

Vitisin A Content in Chilean Wines from Vitis vinifera cv. Cabernet Sauvignon and Contribution to the Color of Aged Red Wines

Crocus sativus

1 reference

stated in

Flavonoid Determination in the Quality Control of Floral Bioresidues from Crocus sativus L

soybean

1 reference

stated in

Isolation and determination of anthocyanins in seed coats of black soybean (Glycine max (L.) Merr.).

Aronia melanocarpa

1 reference

stated in

Characterization of anthocyanins and proanthocyanidins in some cultivars of Ribes, Aronia, and Sambucus and their antioxidant capacity

Ribes rubrum

1 reference

stated in

Characterization of anthocyanins and proanthocyanidins in some cultivars of Ribes, Aronia, and Sambucus and their antioxidant capacity

Ribes uva-crispa

1 reference

stated in

Characterization of anthocyanins and proanthocyanidins in some cultivars of Ribes, Aronia, and Sambucus and their antioxidant capacity

Sambucus nigra

1 reference

stated in

Characterization of anthocyanins and proanthocyanidins in some cultivars of Ribes, Aronia, and Sambucus and their antioxidant capacity

Identifiers

InChI

InChI=1S/C22H22O12/c1-31-14-3-8(2-12(26)17(14)27)21-15(6-10-11(25)4-9(24)5-13(10)32-21)33-22-20(30)19(29)18(28)16(7-23)34-22/h2-6,16,18-20,22-23,28-30H,7H2,1H3,(H3-,24,25,26,27)/t16-,18-,19+,20-,22-/m1/s1

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InChIKey

CCQDWIRWKWIUKK-QKYBYQKWSA-N

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ChEBI ID

193103

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C22H22O12/c1-31-14-3-8(2-12(26)17(14)27)21-15(6-10-11(25)4-9(24)5-13(10)32-21)33-22-20(30)19(29)18(28)16(7-23)34-22/h2-6,16,18-20,22-23,28-30H,7H2,1H3,(H3-,24,25,26,27)/t16-,18-,19+,20-,22-/m1/s1

(Q103785095)

5,7-dihydroxy-2-(3-hydroxy-5-methoxy-4-oxidophenyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1λ⁴-chromen-1-ylium

Statements

Identifiers

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