Found 63 results

Search term: MF = 'C_{33}H_{40}O_{22}'
ChemSpider 2D Image | 2-(3,4-Dihydroxyphenyl)-5-hydroxy-3-(beta-D-mannopyranosyloxy)-4-oxo-4H-chromen-7-yl 6-O-beta-D-galactopyranosyl-beta-D-galactopyranoside | C33H40O22

2-(3,4-Dihydroxyphenyl)-5-hydroxy-3-(β-D-mannopyranosyloxy)-4-oxo-4H-chromen-7-yl 6-O-β-D-galactopyranosyl-β-D-galactopyranoside

  • Molecular FormulaC33H40O22
  • Average mass788.657 Da
  • Monoisotopic mass788.201111 Da
  • ChemSpider ID114642436

  • defined stereocentres - 15 of 15 defined stereocentres

More details:

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

2-(3,4-Dihydroxyphenyl)-5-hydroxy-3-(β-D-mannopyranosyloxy)-4-oxo-4H-chromen-7-yl 6-O-β-D-galactopyranosyl-β-D-galactopyranoside [ACD/IUPAC Name]
2-(3,4-Dihydroxyphenyl)-5-hydroxy-3-(β-D-mannopyranosyloxy)-4-oxo-4H-chromen-7-yl-6-O-β-D-galactopyranosyl-β-D-galactopyranosid [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-7-[(6-O-β-D-galactopyranosyl-β-D-galactopyranosyl)oxy]-5-hydroxy-3-(β-D-mannopyranosyloxy)- [ACD/Index Name]
6-O-β-D-Galactopyranosyl-β-D-galactopyranoside de 2-(3,4-dihydroxyphényl)-5-hydroxy-3-(β-D-mannopyranosyloxy)-4-oxo-4H-chromén-7-yle [French] [ACD/IUPAC Name]
2-(3,4-dihydroxyphenyl)-5-hydroxy-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
60778-02-1 [RN]
Quercetin 3-O-β-D-glucose-7-O-β-D-gentiobioside
Quercetin-3-O-??-D-glucose-7-O-??-D-gentiobiosiden

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

Density: 1.9±0.1 g/cm3
Boiling Point: 1189.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 184.6±3.0 kJ/mol
Flash Point: 371.7±27.8 °C
Index of Refraction: 1.776
Molar Refractivity: 173.4±0.4 cm3
#H bond acceptors: 22
#H bond donors: 14
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: -1.89
ACD/LogD (pH 5.5): -2.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 365 Å2
Polarizability: 68.8±0.5 10-24cm3
Surface Tension: 140.1±5.0 dyne/cm
Molar Volume: 414.9±5.0 cm3

Click to predict properties on the Chemicalize site


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