ChemSpider 2D Image | (1aS,1bS,2S,6S,6aS)-6-Hydroxy-1a-(hydroxymethyl)octahydrooxireno[4,5]cyclopenta[1,2-c]pyran-2-yl beta-D-glucopyranoside | C15H24O10

(1aS,1bS,2S,6S,6aS)-6-Hydroxy-1a-(hydroxymethyl)octahydrooxireno[4,5]cyclopenta[1,2-c]pyran-2-yl β-D-glucopyranoside

  • Molecular FormulaC15H24O10
  • Average mass364.345 Da
  • Monoisotopic mass364.136932 Da
  • ChemSpider ID114951869

  • defined stereocentres - 10 of 11 defined stereocentres

More details:

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

(1aS,1bS,2S,5aS,6S,6aS)-6-Hydroxy-1a-(hydroxymethyl)octahydrooxireno[4,5]cyclopenta[1,2-c]pyran-2-yl β-D-glucopyranoside [ACD/IUPAC Name]
(1aS,1bS,2S,5aS,6S,6aS)-6-Hydroxy-1a-(hydroxymethyl)octahydrooxireno[4,5]cyclopenta[1,2-c]pyran-2-yl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
(1aS,1bS,2S,6S,6aS)-6-Hydroxy-1a-(hydroxymethyl)octahydrooxireno[4,5]cyclopenta[1,2-c]pyran-2-yl β-D-glucopyranoside [ACD/IUPAC Name]
(1aS,1bS,2S,6S,6aS)-6-Hydroxy-1a-(hydroxymethyl)octahydrooxireno[4,5]cyclopenta[1,2-c]pyran-2-yl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
β-D-Glucopyranoside de (1aS,1bS,2S,5aS,6S,6aS)-6-hydroxy-1a-(hydroxyméthyl)octahydrooxiréno[4,5]cyclopenta[1,2-c]pyran-2-yle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside de (1aS,1bS,2S,6S,6aS)-6-hydroxy-1a-(hydroxyméthyl)octahydrooxiréno[4,5]cyclopenta[1,2-c]pyran-2-yle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, (1aS,1bS,2S,5aS,6S,6aS)-octahydro-6-hydroxy-1a-(hydroxymethyl)oxireno[4,5]cyclopenta[1,2-c]pyran-2-yl [ACD/Index Name]
β-D-Glucopyranoside, (1aS,1bS,2S,6S,6aS)-octahydro-6-hydroxy-1a-(hydroxymethyl)oxireno[4,5]cyclopenta[1,2-c]pyran-2-yl [ACD/Index Name]
(2S,3R,4S,5S,6R)-2-[[(1S,2S,4S,5S,10S)-5-hydroxy-2-(hydroxymethyl)-3,9-dioxatricyclo[4.4.0.02,4]decan-10-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
6736-86-3 [RN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.7±0.1 g/cm3
Boiling Point: 661.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.5 mmHg at 25°C
Enthalpy of Vaporization: 111.4±6.0 kJ/mol
Flash Point: 353.8±31.5 °C
Index of Refraction: 1.654
Molar Refractivity: 79.3±0.4 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -3.88
ACD/LogD (pH 5.5): -3.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 162 Å2
Polarizability: 31.4±0.5 10-24cm3
Surface Tension: 93.1±5.0 dyne/cm
Molar Volume: 216.4±5.0 cm3

Click to predict properties on the Chemicalize site


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