Found 1 result

Search term: 78436232 (Found by CSID)
ChemSpider 2D Image | (3aS,12aR)-4,6-Dihydroxy-5-oxo-2,3,3a,12a-tetrahydro-5H-furo[3',2':4,5]furo[3,2-b]xanthen-8-yl 4-O-methyl-alpha-D-glucopyranoside | C24H24O12

(3aS,12aR)-4,6-Dihydroxy-5-oxo-2,3,3a,12a-tetrahydro-5H-furo[3',2':4,5]furo[3,2-b]xanthen-8-yl 4-O-methyl-α-D-glucopyranoside

  • Molecular FormulaC24H24O12
  • Average mass504.440 Da
  • Monoisotopic mass504.126770 Da
  • ChemSpider ID78436232

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(3aS,12aR)-4,6-Dihydroxy-5-oxo-2,3,3a,12a-tetrahydro-5H-furo[3',2':4,5]furo[3,2-b]xanthen-8-yl 4-O-methyl-α-D-glucopyranoside [ACD/IUPAC Name]
(3aS,12aR)-4,6-Dihydroxy-5-oxo-2,3,3a,12a-tetrahydro-5H-furo[3',2':4,5]furo[3,2-b]xanthen-8-yl-4-O-methyl-α-D-glucopyranosid [German] [ACD/IUPAC Name]
4-O-Méthyl-α-D-glucopyranoside de (3aS,12aR)-4,6-dihydroxy-5-oxo-2,3,3a,12a-tétrahydro-5H-furo[3',2':4,5]furo[3,2-b]xanthén-8-yle [French] [ACD/IUPAC Name]
5H-Furo[3',2':4,5]furo[3,2-b]xanthen-5-one, 2,3,3a,12a-tetrahydro-4,6-dihydroxy-8-[(4-O-methyl-α-D-glucopyranosyl)oxy]-, (3aS,12aR)- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 782.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 119.5±3.0 kJ/mol
Flash Point: 270.8±26.4 °C
Index of Refraction: 1.735
Molar Refractivity: 116.9±0.4 cm3
#H bond acceptors: 12
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 3
ACD/LogP: 0.38
ACD/LogD (pH 5.5): 1.07
ACD/BCF (pH 5.5): 3.58
ACD/KOC (pH 5.5): 80.23
ACD/LogD (pH 7.4): -0.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.14
Polar Surface Area: 174 Å2
Polarizability: 46.3±0.5 10-24cm3
Surface Tension: 102.0±5.0 dyne/cm
Molar Volume: 291.3±5.0 cm3

Click to predict properties on the Chemicalize site


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