ChemSpider 2D Image | Malvin | C29H35O17

Malvin

  • Molecular FormulaC29H35O17
  • Average mass655.578 Da
  • Monoisotopic mass655.186890 Da
  • ChemSpider ID390365

  • Charge - Charge

    defined stereocentres - 10 of 10 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

3-(β-D-Glucopyranosyloxy)-7-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-5-chromeniumyl β-D-glucopyranoside [ACD/IUPAC Name]
3-(β-D-Glucopyranosyloxy)-7-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-5-chromeniumyl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
Malvidin-3,5-diglucoside
malvidin-3,5-di-O-glucoside
Malvin [Wiki]
β-D-Glucopyranoside de 3-(β-D-glucopyranosyloxy)-7-hydroxy-2-(4-hydroxy-3,5-diméthoxyphényl)-5-chroméniumyle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, 3-(β-D-glucopyranosyloxy)-7-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-1-benzopyrylium-5-yl [ACD/Index Name]
(2S,3R,4S,5R,6R)-2-[7-hydroxy-2-(4-hydroxy-3,5-dimethoxy-phenyl)-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-chromen-5-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
3-(β-D-glucopyranosyloxy)-7-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)chromenium-5-yl β-D-glucopyranoside
3,5-Bis(β-D-glucopyranosyloxy)-7-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-1-benzopyrylium
More...

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

C08718 [DBID]
  • Miscellaneous

    • Chemical Class:

      An anthocyanin cation that is malvidin carrying two beta-D-glucosyl residues at positions 3 and 5. ChEBI CHEBI:75030

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 17
#H bond donors: 10
#Freely Rotating Bonds: 9
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 271 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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