ChemSpider 2D Image | 3-(beta-D-Glucopyranosyloxy)-2-(3,4,5-trihydroxyphenyl)-5,7-chromeniumdiolate | C21H19O12

3-(β-D-Glucopyranosyloxy)-2-(3,4,5-trihydroxyphenyl)-5,7-chromeniumdiolate

  • Molecular FormulaC21H19O12
  • Average mass463.369 Da
  • Monoisotopic mass463.088196 Da
  • ChemSpider ID128920551

  • Charge - Charge

    defined stereocentres - 5 of 5 defined stereocentres

More details:

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

3-(β-D-Glucopyranosyloxy)-2-(3,4,5-trihydroxyphenyl)-5,7-chromeniumdiolat [German] [ACD/IUPAC Name]
3-(β-D-Glucopyranosyloxy)-2-(3,4,5-trihydroxyphenyl)-5,7-chromeniumdiolate [ACD/IUPAC Name]
3-(β-D-Glucopyranosyloxy)-2-(3,4,5-trihydroxyphényl)-5,7-chroméniumdiolate [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, 5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-1-benzopyrylium-3-yl, inner salt, ion(1-) [ACD/Index Name]
delfinidin-3-O-glucoside
delphinidin-3-<i>O</i>-&amp;β
-D-glucoside

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: 12
#H bond donors: 9
#Freely Rotating Bonds: 4
#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: 219 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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