petunidin 3-O-beta-D-glucoside (Q7179425)

Petunidin 3-glucoside (English)

2-(3,4-Dihydroxy-5-methoxyphenyl)-3-(beta-D-galactopyranosyloxy)-5,7-dihydroxy-1-benzopyrylium

6 October 2016

stereoisomer of

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₂H₂₃O₁₂⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

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

1 reference

Petunidin 3-glucoside (English)

6 October 2016

isomeric SMILES

COC1=CC(=CC(=C1O)O)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

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

Petunidin 3-glucoside (English)

6 October 2016

7 references

Structural dependence of HPLC separation pattern of anthocyanins from Bilberry (Vaccinium myrtillus L.).

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

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

In vitro and In vivo Antioxidant Properties ofVaccinium myrtillus

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

Complete assignment of bilberry (Vaccinium myrtillus L.) anthocyanins separated by capillary zone electrophoresis

Ribes nigrum

2 references

Determination of Authenticity of Fruit Jams by HPLC Analysis of Anthocyanins

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

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

1 reference

Determination of Authenticity of Fruit Jams by HPLC Analysis of Anthocyanins

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

Catharanthus roseus

1 reference

Production of anthocyanins by Catharanthus roseus

Eugenia umbelliflora

1 reference

Characterization of anthocyanins from the fruits of baguaçu (Eugenia umbelliflora Berg).

soybean

1 reference

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

Picea

1 reference

Anthocyanins in cones of Abies, Picea, Pinus, Pseudotsuga and Tsuga (Pinaceae)

Pinus banksiana

1 reference

Anthocyanins of jack pine (Pinus banksiana) seedlings

Pseudotsuga

1 reference

Anthocyanins in cones of Abies, Picea, Pinus, Pseudotsuga and Tsuga (Pinaceae)

Tsuga

1 reference

Anthocyanins in cones of Abies, Picea, Pinus, Pseudotsuga and Tsuga (Pinaceae)

Vaccinium padifolium

1 reference

Anthocyanins in blue berries of Vaccinium padifolium

Bambara groundnut

1 reference

Anthocyanins from Bambara Groundnut (Vignasubterranea)

Berberis integerrima

1 reference

Chromatographic investigation of the anthocyanin pigments of the fruit of some species of barberry

Berberis koreana

1 reference

Chromatographic investigation of the anthocyanin pigments of the fruit of some species of barberry

Berberis sieboldii

1 reference

Chromatographic investigation of the anthocyanin pigments of the fruit of some species of barberry

Berberis vulgaris

1 reference

Chromatographic investigation of the anthocyanin pigments of the fruit of some species of barberry

Cotinus coggygria

1 reference

Anthocyanins in leaves of Cotinus coggygria

Hibiscus syriacus

1 reference

Anthocyanidin malonylglucosides in flowers of Hibiscus syriacus

Phaseolus vulgaris

3 references

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

Characterization of Black Bean (Phaseolus vulgarisL.) Anthocyanins

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

Vaccinium arboreum

1 reference

ANTHOCYANINS IN RIPE FRUIT OF THE SPARKLEBERRY, Vaccinium arboreum MARSH

Vaccinium corymbosum

4 references

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

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

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

Vitis vinifera

9 references

HPLC/MS Application to Anthocyanins of Vitis vinifera L.

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

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

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

Inhibition of rat mammary tumorigenesis by concord grape juice constituents.

Aronia melanocarpa

1 reference

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

Ribes rubrum

1 reference

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

Ribes uva-crispa

1 reference

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

Sambucus nigra

1 reference

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

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

Crocus sativus

1 reference

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

Visnea mocanera

1 reference

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

bog bilberry

1 reference

Anthocyanins in Fruits ofVaccinium UhginosumL. (Bog Whortleberry)

Rubus

1 reference

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

Allium cepa

1 reference

Flavonoid and carbohydrate contents in Tropea red onions: effects of homelike peeling and storage.

Myrtus communis

1 reference

Myrtus communis Berry Color Morphs: A Comparative Analysis of Essential Oils, Fatty Acids, Phenolic Compounds, and Antioxidant Activities

Capsicum annuum

1 reference

Integrative analysis of metabolome and transcriptome reveals the mechanism of color formation in pepper fruit (Capsicum annuum L.).

Berberis heteropoda

1 reference

Chromatographic investigation of the anthocyanin pigments of the fruit of some species of barberry

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)/p+1/t16-,18-,19+,20-,22-/m1/s1

1 reference

Petunidin 3-glucoside (English)

6 October 2016

2 references

Petunidin 3-glucoside (English)

6 October 2016

ChEBI release 2020-09-01

1 reference

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

6 October 2016

1 reference

Petunidin-3-O-beta-glucopyranoside (English)

6 October 2016

2 references

Petunidin 3-glucoside (English)

6 October 2016

Reaxys registry number

1613022

1 reference

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

6 October 2016

ChEBI ID

31985

mapping relation type

2 references

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

6 October 2016

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)/p+1/t16-,18-,19+,20-,22-/m1/s1

1 reference

splash10-02di-0179400000-8c080d5270ed5c16fe1d

CHEMBL1784264 (English)

6 October 2016

1 reference

MassBank accession ID

MSBNK-RIKEN-PR100455

0 references

MSBNK-RIKEN-PR100913

0 references

SPLASH

0 references

splash10-004i-0000900000-7301bdab6051b125c428

0 references

splash10-016r-0008900000-4ea6cccc6d99375f2545

0 references

splash10-014i-0009000000-fbd3ba5cd7c5a5479224

0 references

splash10-014i-0009000000-83480eb1a7b186450678

0 references

splash10-014i-0009000000-8a732acc70cad63c2585

0 references

splash10-014i-0009000000-5c5de0c5729541138e91

0 references

splash10-014i-0019100000-5a17dc990408af3c64fe

0 references

DSSTox substance ID

DTXSID40990158

1 reference

DSSTOX compound identifier

DTXCID701417263

0 references

Human Metabolome Database ID

HMDB0038097

2 references

based on heuristic

inferred from InChIKey

1 reference

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

reason for deprecated rank

6 October 2016

UNII

AA9G36JBHT

cannot be confirmed by other sources

0 references

1 reference