ChemSpider 2D Image | delphinidin 3-O-beta-D-glucoside-5-O-beta-D-glucoside betaine | C27H30O17

delphinidin 3-O-β-D-glucoside-5-O-β-D-glucoside βine

  • Molecular FormulaC27H30O17
  • Average mass626.517 Da
  • Monoisotopic mass626.148315 Da
  • ChemSpider ID31150403

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

3,5-Bis(β-D-glucopyranosyloxy)-2-(3,4,5-trihydroxyphenyl)-7-chromeniumolat [German] [ACD/IUPAC Name]
3,5-Bis(β-D-glucopyranosyloxy)-2-(3,4,5-trihydroxyphenyl)-7-chromeniumolate [ACD/IUPAC Name]
3,5-Bis(β-D-glucopyranosyloxy)-2-(3,4,5-trihydroxyphényl)-7-chroméniumolate [French] [ACD/IUPAC Name]
delphinidin 3-O-β-D-glucoside-5-O-β-D-glucoside βine
β-D-Glucopyranoside, 3-(β-D-glucopyranosyloxy)-7-hydroxy-2-(3,4,5-trihydroxyphenyl)-1-benzopyrylium-5-yl, inner salt [ACD/Index Name]
3,5-bis(β-D-glucopyranosyloxy)-2-(3,4,5-trihydroxyphenyl)chromenium-7-olate
delphinidin 3,5-bis-O-β-D-glucoside
delphinidin 3,5-di-<i>O</i>;-&β;-D-glucoside
delphinidin-3,5-diglucoside
  • Miscellaneous

    • Chemical Class:

      An oxonium betaine obtained by deprotonation of the 7-hydroxy group of delphinidin 3-<element>O</element>-<stereo>beta</stereo>-<stereo>D</stereo>-glucoside-5-<element>O</element>-<stereo>beta</stereo >-<stereo>D</stereo>-glucoside. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). ChEBI CHEBI:77838
      An oxonium betaine obtained by deprotonation of the 7-hydroxy group of delphinidin 3-O-beta-D-glucoside-5-O-beta-D-glucoside. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:77838

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 17
#H bond donors: 12
#Freely Rotating Bonds: 7
#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: 296 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement