Vitisin A (BioCAD00000032850)

plant natural products

Metabolite Card

Chinese Name:
Formula: C26H25O14 (561.1244)
SMILES:

COC1=CC(=CC(OC)=C1O)C1=[O+]C2=C3C(OC(=CC3=C1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(O)=O)=CC(O)=C2

Synonyms [en]

Malvidin 3-glucoside-pyruvate; Vitisin A; 11-hydroxy-7-(4-hydroxy-3,5-dimethoxy-phenyl)-6-[(2~{R},3~{S},4~{R},5~{S},6~{R})-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-2-oxa-8-oxoniatricyclo[7.3.1.0^{5,13}]trideca-1(13),3,5,7,9,11-hexaene-3-carboxylic acid; 7-carboxy-11-hydroxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2lambda4,8-dioxatricyclo[7.3.1.0^{5,13}]trideca-1(13),2,4,6,9,11-hexaen-2-ylium; 11-hydroxy-7-(4-hydroxy-3,5-dimethoxy-phenyl)-6-[(2~{S},3~{R},4~{S},5~{S},6~{R})-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-2-oxa-8-oxoniatricyclo[7.3.1.0^{5,13}]trideca-1(13),3,5,7,9,11-hexaene-3-carboxylic acid; 7-carboxy-11-hydroxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2$l^{4},8-dioxatricyclo[7.3.1.0^{5,13}]trideca-1(13),2,4,6,9,11-hexaen-2-ylium

Note

Vitisin A is found in alcoholic beverages. Vitisin A is a constituent of some red wines

Entity Information

DBLinks

Other DBLinks
  • CAS Registry Number: 184362-09-2
  • CAS Registry Number: 388089-38-1
  • PubChem: 102317071
  • PubChem: 44257034
  • HMDB: HMDB0036348
  • HMDB: HMDB36348
  • LipidMaps: LMPK12010434
  • Wikipedia: Vitisin A
  • Metlin: METLIN_91492
  • Coconut NaturalProduct: CNP0572347.1
  • Coconut NaturalProduct: CNP0572347.2
  • Coconut NaturalProduct: CNP0577409.2
  • metaboanalyst: 0e4658cd0970c211bf8bf4c6f5758abe
  • metaboanalyst: 2124f682c06243d1654e0483ad8ae63d
  • metaboanalyst: cb6d02e9a814c75b3d511af9a10c8be8

Class / Ontology

Metabolic Network
ID EC Number Name
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Mass Spectrum
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Organism Source

Taxonomy Source

  1. Vitis vinifera [ncbi taxid: 29760]

Pathway Synthetic

pathway id name
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