malvidin 3-O-beta-D-glucoside (Q137147)

Malvidin-3-glucoside (English)

(2S,3R,4S,5R,6S)-2-[5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)chromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

6 October 2016

stereoisomer of

1 reference

(2S,3S,4R,5S,6R)-2-[5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)chromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

inferred from InChI

1 reference

malvidin-3-O-beta-D-galactoside

inferred from InChI

1 reference

inferred from InChI

chemical formula

C₂₃H₂₅O₁₂⁺

1 reference

Malvidin-3-glucoside (English)

6 October 2016

canonical SMILES

COC1=CC(=CC(=C1O)OC)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)OC4C(C(C(C(O4)CO)O)O)O

1 reference

Malvidin-3-glucoside (English)

6 October 2016

isomeric SMILES

COC1=CC(=CC(=C1O)OC)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O

1 reference

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

Malvidin-3-glucoside (English)

6 October 2016

17 references

Inhibition of rat mammary tumorigenesis by concord grape juice constituents.

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

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

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

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

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

Investigations on Anthocyanins in Wines from Vitis vinifera cv. Pinotage: Factors Influencing the Formation of Pinotin A and Its Correlation with Wine Age

Principal Phenolic Phytochemicals in Selected California Wines and Their Antioxidant Activity in Inhibiting Oxidation of Human Low-Density Lipoproteins

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

Wine phenolics: contribution to dietary intake and bioavailability

Effect of Postharvest Ultraviolet Irradiation on Resveratrol and Other Phenolics of Cv. Napoleon Table Grapes

Antioxidant Activity of the Stilbene Astringin, Newly Extracted from Vitis vinifera Cell Cultures

Comparative study of radical scavenger and antioxidant properties of phenolic compounds from Vitis vinifera cell cultures using in vitro tests

Antioxidative activity of monoacylated anthocyanins isolated from Muscat Bailey A grape

Production of 13C-labelled anthocyanins by Vitis vinifera cell suspension cultures

Investigations on anthocyanins in wines from Vitis vinifera cv. pinotage: factors influencing the formation of pinotin A and its correlation with wine age.

Ribes nigrum

1 reference

Determination of Authenticity of Fruit Jams by HPLC Analysis of Anthocyanins

Vaccinium angustifolium

2 references

Determination of Authenticity of Fruit Jams by HPLC Analysis of Anthocyanins

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

Rubus idaeus

2 references

Determination of Authenticity of Fruit Jams by HPLC Analysis of Anthocyanins

Differentiation of raspberry varieties according to anthocyanin composition

Fragaria

1 reference

Determination of Authenticity of Fruit Jams by HPLC Analysis of Anthocyanins

Prunus avium

1 reference

Determination of Authenticity of Fruit Jams by HPLC Analysis of Anthocyanins

Vaccinium padifolium

1 reference

Anthocyanins in blue berries of Vaccinium padifolium

Anagallis arvensis

1 reference

Chemosystematics of Anagallis arvensis L. (Primulaceae)

Vaccinium corymbosum

4 references

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

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

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

Fractionation and identification of the phenolic compounds of Highbush blueberries (Vaccinium corymbosum, L.)

Visnea mocanera

1 reference

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

Vitis aestivalis

1 reference

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

Clarkia speciosa

1 reference

Anthocyanin variation in an introgressive complex in Clarkia

Phaseolus vulgaris

3 references

Characterization of Black Bean (Phaseolus vulgarisL.) Anthocyanins

Structural Analysis and Measurement of Anthocyanins from Colored Seed Coats ofVigna, Phaseolus, andGlycineLegumes

Germplasm characterization of Zolfino landraces (Phaseolus vulgaris L.) by flavonoid content

Vaccinium myrtillus

4 references

Qualitative and quantitative evaluation of vaccinium myrtillus anthocyanins by high-resolution gas chromatography and high-performance liquid chromatography

Computer-aided evaluation of the relative stability of Vaccinium myrtillus anthocyanins

A NOVEL SOLID-PHASE EXTRACTION-HPLC METHOD FOR THE ANALYSIS OF ANTHOCYANIN AND ORGANIC ACID COMPOSITION OF FINNISH CRANBERRY

Application of RP-HPLC and Spectrophotometry in Standardization of Bilberry Anthocyanin Extract

bog bilberry

1 reference

Anthocyanins in Fruits ofVaccinium UhginosumL. (Bog Whortleberry)

Hibiscus syriacus

1 reference

Anthocyanidin malonylglucosides in flowers of Hibiscus syriacus

Nidularium innocentii

1 reference

A cyanidin glycoside giving scarlet coloration in plants of the bromeliaceae

Malvaviscus arboreus

1 reference

INVESTIGATION OF FLOWER ANTHOCYANIN PIGMENTS OF ALTHEA ROSEA CAV. AND MALVA VISCOUS-ARBOREA L. GROWING IN EGYPT

Vaccinium arboreum

1 reference

ANTHOCYANINS IN RIPE FRUIT OF THE SPARKLEBERRY, Vaccinium arboreum MARSH

Rubus

1 reference

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

physically interacts with

taste receptor type 2

subject has role

agonist

1 reference

Different phenolic compounds activate distinct human bitter taste receptors.

1 reference

Identifiers

InChI

InChI=1S/C23H24O12/c1-31-14-3-9(4-15(32-2)18(14)27)22-16(7-11-12(26)5-10(25)6-13(11)33-22)34-23-21(30)20(29)19(28)17(8-24)35-23/h3-7,17,19-21,23-24,28-30H,8H2,1-2H3,(H2-,25,26,27)/p+1/t17-,19-,20+,21-,23-/m1/s1

1 reference

Malvidin-3-glucoside (English)

6 October 2016

2 references

Malvidin-3-glucoside (English)

6 October 2016

ChEBI release 2020-09-01

1 reference

malvidin 3-O-beta-D-glucoside (English)

6 October 2016

1 reference

Oenin (English)

6 October 2016

2 references

Malvidin-3-glucoside (English)

6 October 2016

Reaxys registry number

1696096

1 reference

malvidin 3-O-beta-D-glucoside (English)

6 October 2016

ChEBI ID

31799

mapping relation type

2 references

malvidin 3-O-beta-D-glucoside (English)

6 October 2016

International Chemical Identifier

InChI

InChI=1S/C23H24O12/c1-31-14-3-9(4-15(32-2)18(14)27)22-16(7-11-12(26)5-10(25)6-13(11)33-22)34-23-21(30)20(29)19(28)17(8-24)35-23/h3-7,17,19-21,23-24,28-30H,8H2,1-2H3,(H2-,25,26,27)/p+1/t17-,19-,20+,21-,23-/m1/s1

1 reference

splash10-001i-0009100000-bbda7893855eb8d30b35

OENIN (English)

6 October 2016

1 reference

MassBank accession ID

0 references

0 references

0 references

0 references

splash10-01t9-0039200000-77ef9771ee1d763a34e0

0 references

splash10-0006-0000900000-efa7fb1eb4199d59d9eb

0 references

splash10-000x-0007900000-1f3882e441d62bc7244a

0 references

splash10-001i-0009000000-6bd1d600c15f86607157

0 references

splash10-001i-0009000000-325dd14df2cf958e203c

0 references

splash10-001i-0009000000-cf2b89346174845737d8

0 references

splash10-001i-0019000000-45d721b631f90673dd4f

0 references

DSSTox substance ID

DTXSID30332124

2 references

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

DSSTOX compound identifier

0 references

0 references

230-631-9

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.027.847

27 December 2018

ECHA Substance Infocard ID

3-(β-D-glucopyranosyloxy)-5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-1-benzopyrylium chloride (English)

quotation

CAS no.: 7228-78-6 (English)

100.027.847

1 reference

reference URL

http://echa.europa.eu/de/information-on-chemicals/registered-substances

Human Metabolome Database ID

HMDB0030777

2 references

inferred from InChIKey

1 reference

malvidin 3-O-beta-D-glucoside (English)

reason for deprecated rank

6 October 2016

UNII

B34F52D7NB

cannot be confirmed by other sources

0 references

1 reference