(Q27145473)

Delphinidin 3-(acetylglucoside) (English)

Delphinidin 3-(6-O-acetylgalactoside)

8 October 2016

stereoisomer of

1 reference

inferred from InChI

chemical formula

C₂₃H₂₃O₁₃⁺

1 reference

inferred from SMILES

canonical SMILES

CC(=O)OCC1C(C(C(C(O1)OC2=C([O+]=C3C=C(C=C(C3=C2)O)O)C4=CC(=C(C(=C4)O)O)O)O)O)O

1 reference

Delphinidin 3-(acetylglucoside) (English)

8 October 2016

isomeric SMILES

CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC2=C([O+]=C3C=C(C=C(C3=C2)O)O)C4=CC(=C(C(=C4)O)O)O)O)O)O

1 reference

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

Delphinidin 3-(acetylglucoside) (English)

8 October 2016

1 reference

Vaccinium angustifolium

1 reference

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

Vaccinium corymbosum

2 references

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

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

Vitis vinifera

4 references

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.

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

Identifiers

InChI

InChI=1S/C23H22O13/c1-8(24)33-7-17-19(30)20(31)21(32)23(36-17)35-16-6-11-12(26)4-10(25)5-15(11)34-22(16)9-2-13(27)18(29)14(28)3-9/h2-6,17,19-21,23,30-32H,7H2,1H3,(H4-,25,26,27,28,29)/p+1/t17-,19-,20+,21-,23-/m1/s1

1 reference

Delphinidin 3-(acetylglucoside) (English)

8 October 2016

2 references

Delphinidin 3-(acetylglucoside) (English)

8 October 2016

ChEBI release 2020-09-01

1 reference

5,7-Dihydroxy-2-(3,4,5-trihydroxyphenyl)-3-chromeniumyl 6-O-acetyl-beta-D-glucopyranoside (English)

8 October 2016

2 references

Delphinidin 3-(acetylglucoside) (English)

8 October 2016

Reaxys registry number

9602890

1 reference

delphinidin 3-O-(6-O-acetyl-beta-D-glucoside) (English)

8 October 2016

ChEBI ID

75678

mapping relation type

2 references

delphinidin 3-O-(6-O-acetyl-beta-D-glucoside) (English)

8 October 2016

International Chemical Identifier

InChI

InChI=1S/C23H22O13/c1-8(24)33-7-17-19(30)20(31)21(32)23(36-17)35-16-6-11-12(26)4-10(25)5-15(11)34-22(16)9-2-13(27)18(29)14(28)3-9/h2-6,17,19-21,23,30-32H,7H2,1H3,(H4-,25,26,27,28,29)/p+1/t17-,19-,20+,21-,23-/m1/s1

1 reference

1 reference

Human Metabolome Database ID

HMDB0038004

2 references

inferred from InChIKey

KNApSAcK ID

C00062907

2 references

inferred from InChIKey