Vitisin A (BioCAD00000032850)
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
DBLinks
- CAS Registry Number: 184362-09-2
- PubChem CID: 102317071
- ChEBI:
- HMDB: HMDB0036348
- LipidMaps: LMPK12010434
- KEGG:
- BioCyc:
- NCBI MeSH:
- Wikipedia: Vitisin A
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
- WishartLab ClassyFire: [Biflavonoids and polyflavonoids] Biflavonoids and polyflavonoids
- LipidMaps: [Anthocyanidins [PK1201]] Anthocyanidins [PK1201]
- Coconut NaturalProduct: [Anthocyanidins] Anthocyanidins