Found 63 results

Search term: MF = 'C_{33}H_{40}O_{22}'
ChemSpider 2D Image | delphinidin 3,3',5-tri-O-beta-D-glucoside betaine | C33H40O22

delphinidin 3,3',5-tri-O-β-D-glucoside βine

  • Molecular FormulaC33H40O22
  • Average mass788.657 Da
  • Monoisotopic mass788.201111 Da
  • ChemSpider ID31150407

  • defined stereocentres - 15 of 15 defined stereocentres

More details:

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

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

    • Chemical Class:

      An oxonium betaine obtained by deprotonation of the 7-hydroxy group of delphinidin 3,3',5-tri-<element>O</element>-<stereo>beta</stereo>-<stereo>D</stereo>-glucoside. It is the major microspecies at p H 7.3 (according to Marvin v 6.2.0.). ChEBI CHEBI:77844
      An oxonium betaine obtained by deprotonation of the 7-hydroxy group of delphinidin 3,3',5-tri-O-beta-D-glucoside. It is the major microspecies at p; H 7.3 (according to Marvin v 6.2.0.). ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:77844
      An oxonium betaine obtained by deprotonation of the 7-hydroxy group of delphinidin 3,3',5-tri-O-beta-D-glucoside. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). ChEBI CHEBI:77844

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: 22
#H bond donors: 15
#Freely Rotating Bonds: 10
#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: 375 Å2
Polarizability:
Surface Tension:
Molar Volume:

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