ChemSpider 2D Image | Tricin 5-glucoside | C23H24O12

Tricin 5-glucoside

  • Molecular FormulaC23H24O12
  • Average mass492.430 Da
  • Monoisotopic mass492.126770 Da
  • ChemSpider ID25054061

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

32769-00-9 [RN]
4H-1-Benzopyran-4-one, 5-(β-D-glucopyranosyloxy)-7-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)- [ACD/Index Name]
5-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-7-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
7-Hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxo-4H-chromen-5-yl β-D-glucopyranoside [ACD/IUPAC Name]
7-Hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxo-4H-chromen-5-yl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
Tricin 5-glucoside
Tricin 5-O-β-D-glucopyranoside
tricin 5-O-β-D-glucoside
β-D-Glucopyranoside de 7-hydroxy-2-(4-hydroxy-3,5-diméthoxyphényl)-4-oxo-4H-chromén-5-yle [French] [ACD/IUPAC Name]
5-glucosyltricin
More...
  • Miscellaneous

    • Chemical Class:

      A glycosyloxyflavone that is 3',5'-di-<element>O</element>-methyltricetin (tricin) in which the phenolic hydrogen at position 5 has been replaced by a <stereo>beta</stereo>-<stereo>D</stereo>-glucopy ranosyl group. ChEBI CHEBI:131775
      A glycosyloxyflavone that is 3',5'-di-O-methyltricetin (tricin) in which the phenolic hydrogen at position 5 has been replaced by a beta-D-glucopy; ranosyl group. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:131775
      A glycosyloxyflavone that is 3',5'-di-O-methyltricetin (tricin) in which the phenolic hydrogen at position 5 has been replaced by a beta-D-glucopyranosyl group. ChEBI CHEBI:131775

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

Density: 1.6±0.1 g/cm3
Boiling Point: 841.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 128.2±3.0 kJ/mol
Flash Point: 291.0±27.8 °C
Index of Refraction: 1.676
Molar Refractivity: 117.0±0.3 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -0.88
ACD/LogD (pH 5.5): -0.76
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.74
ACD/LogD (pH 7.4): -1.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 185 Å2
Polarizability: 46.4±0.5 10-24cm3
Surface Tension: 80.1±3.0 dyne/cm
Molar Volume: 311.2±3.0 cm3

Click to predict properties on the Chemicalize site


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