ChemSpider 2D Image | 6-Deoxyhexopyranosyl-(1->4)hexopyranosyl-(1->6)-1-O-{[10,11-dihydroxy-9-(hydroxymethyl)-1,2,6a,9,12a,12b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydro-4-picenyl]carbonyl} hexopyranose | C48H78O19

6-Deoxyhexopyranosyl-(1->4)hexopyranosyl-(1->6)-1-O-{[10,11-dihydroxy-9-(hydroxymethyl)-1,2,6a,9,12a,12b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydro-4-picenyl]carbonyl} hexopyranose

  • Molecular FormulaC48H78O19
  • Average mass959.122 Da
  • Monoisotopic mass958.513733 Da
  • ChemSpider ID364577

More details:

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

6-Deoxyhexopyranosyl-(1->4)hexopyranosyl-(1->6)-1-O-{[10,11-dihydroxy-9-(hydroxymethyl)-1,2,6a,9,12a,12b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydro-4-picenyl]carbonyl} hexopyranose [ACD/IUPAC Name]
6-Desoxyhexopyranosyl-(1->4)hexopyranosyl-(1->6)-1-O-{[10,11-dihydroxy-9-(hydroxymethyl)-1,2,6a,9,12a,12b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydro-4-picenyl]carbonyl }hexopyranose [German] [ACD/IUPAC Name]
6-Désoxyhexopyranosyl-(1->4)hexopyranosyl-(1->6)-1-O-{[10,11-dihydroxy-9-(hydroxyméthyl)-1,2,6a,9,12a,12b-hexaméthyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydro-4-picényl]carbonyl }hexopyranose [French] [ACD/IUPAC Name]
Hexopyranose, O--6-deoxyhexopyranosyl-(1->4)-O-hexopyranosyl-(1->6)-1-O-[[1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-eicosahydro-10,11-dihydroxy-9-(hydroxymethyl)-1,2,6a,9,12a,12b-hexamethy l-4-picenyl]carbonyl]- [ACD/Index Name]
Asiaticoside

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

NSC36002 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 1021.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 169.0±6.0 kJ/mol
Flash Point: 289.5±27.8 °C
Index of Refraction: 1.628
Molar Refractivity: 236.1±0.4 cm3
#H bond acceptors: 19
#H bond donors: 12
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 3.29
ACD/LogD (pH 5.5): 2.17
ACD/BCF (pH 5.5): 26.27
ACD/KOC (pH 5.5): 360.95
ACD/LogD (pH 7.4): 2.17
ACD/BCF (pH 7.4): 26.27
ACD/KOC (pH 7.4): 360.95
Polar Surface Area: 315 Å2
Polarizability: 93.6±0.5 10-24cm3
Surface Tension: 76.8±5.0 dyne/cm
Molar Volume: 665.0±5.0 cm3

Click to predict properties on the Chemicalize site


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