Found 22 results

Search term: MF = 'C_{30}H_{36}O_{17}'
ChemSpider 2D Image | 2-(1,3-Benzodioxol-5-yl)-5,6-dimethoxy-4-oxo-3,4-dihydro-2H-chromen-7-yl 6-O-D-glucopyranosyl-D-glucopyranoside | C30H36O17

2-(1,3-Benzodioxol-5-yl)-5,6-dimethoxy-4-oxo-3,4-dihydro-2H-chromen-7-yl 6-O-D-glucopyranosyl-D-glucopyranoside

  • Molecular FormulaC30H36O17
  • Average mass668.597 Da
  • Monoisotopic mass668.195251 Da
  • ChemSpider ID28287679

  • defined stereocentres - 8 of 11 defined stereocentres

More details:

Featured data source
Natural Product Updates

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

2-(1,3-Benzodioxol-5-yl)-5,6-dimethoxy-4-oxo-3,4-dihydro-2H-chromen-7-yl 6-O-D-glucopyranosyl-D-glucopyranoside [ACD/IUPAC Name]
2-(1,3-Benzodioxol-5-yl)-5,6-dimethoxy-4-oxo-3,4-dihydro-2H-chromen-7-yl-6-O-D-glucopyranosyl-D-glucopyranosid [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 2-(1,3-benzodioxol-5-yl)-7-[(6-O-D-glucopyranosyl-D-glucopyranosyl)oxy]-2,3-dihydro-5,6-dimethoxy- [ACD/Index Name]
6-O-D-Glucopyranosyl-D-glucopyranoside de 2-(1,3-benzodioxol-5-yl)-5,6-diméthoxy-4-oxo-3,4-dihydro-2H-chromén-7-yle [French] [ACD/IUPAC Name]
5,6-dimethyoxy-3',4'-dioxymethylene-7-O-(6''-b-D-glucopyranosyl-b-D-glucopyranosyl) flavanone

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

Density: 1.7±0.1 g/cm3
Boiling Point: 938.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 143.1±3.0 kJ/mol
Flash Point: 303.3±27.8 °C
Index of Refraction: 1.684
Molar Refractivity: 152.9±0.4 cm3
#H bond acceptors: 17
#H bond donors: 7
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: -0.34
ACD/LogD (pH 5.5): -1.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.57
ACD/LogD (pH 7.4): -1.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.57
Polar Surface Area: 242 Å2
Polarizability: 60.6±0.5 10-24cm3
Surface Tension: 94.4±5.0 dyne/cm
Molar Volume: 402.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement