Malvidin

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Systematic / IUPAC Name: 3,5,7-Trihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)chromenium

ID: Reference903

Other Names: 1-Benzopyrylium, 3,5,7-trihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-;
3,5,7,4'-Tetrahydroxy-3',5'-dimethoxyflavylium;
Benzopyrylium, 3 5,7-trihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-;
2-(4-Hydroxy-3,5-dimethoxyphenyl)chromenylium-3,5,7-triol;
Malvidol ; more

Formula: C17H15O7 +

Class: Endogenous Metabolites

Spectral Data

Malvidin mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 1
No. of Spectra 163
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods ESI
Analyzers FT
Last Modification 3/26/2015 9:50:23 AM
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Identificators

InChI InChI=1S/C17H14O7/c1-22-14-3-8(4-15(23-2)16(14)21)17-12(20)7-10-11(19)5-9(18)6-13(10)24-17/h3-7H,1-2H3,(H3-,18,19,20,21)/p+1
InChI Key KZMACGJDUUWFCH-UHFFFAOYSA-O
Canonical SMILES COC1=CC(=CC(=C1O)OC)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)O
CAS 10463840
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Other Names 1-Benzopyrylium, 3,5,7-trihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-;
3,5,7,4'-Tetrahydroxy-3',5'-dimethoxyflavylium;
Benzopyrylium, 3 5,7-trihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-;
2-(4-Hydroxy-3,5-dimethoxyphenyl)chromenylium-3,5,7-triol;
Malvidol;
Malvinidin;
Oenidin;
Enidin;
Primulidin;
Syringidin

In Other Databases

Wikipedia Malvidin
ChemIDPlus 010463840
ChEMBL CHEMBL255753
ChemSpider 140095
HMDb HMDB03201
PubChem 159287
ChEBI CHEBI:6674
KEGG C08716