ChemSpider 2D Image | 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-16-(formyloxy)-14-hydroxycard-20(22)-enolide | C31H46O10

3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-16-(formyloxy)-14-hydroxycard-20(22)-enolide

  • Molecular FormulaC31H46O10
  • Average mass578.691 Da
  • Monoisotopic mass578.309082 Da
  • ChemSpider ID171255

More details:

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

3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-16-(formyloxy)-14-hydroxycard-20(22)-enolide [ACD/IUPAC Name]
3-[(6-Desoxy-3-O-methylhexopyranosyl)oxy]-16-(formyloxy)-14-hydroxycard-20(22)-enolid [German] [ACD/IUPAC Name]
3-[(6-Désoxy-3-O-méthylhexopyranosyl)oxy]-16-(formyloxy)-14-hydroxycard-20(22)-énolide [French] [ACD/IUPAC Name]
Card-20(22)-enolide, 3-[(6-deoxy-3-O-methylhexopyranosyl)oxy]-16-(formyloxy)-14-hydroxy- [ACD/Index Name]
(3β,5β,16β)-3-((6-Deoxy-3-O-methyl-D -galactopyranosyl)oxy)-14,16-dihydroxycard-20(22)-enolide 16-formate
229-976-8 [EINECS]
4-18-00-02478 [Beilstein]
6875-10-1 [RN]
Gitaloxigenin + digitalose [German]
Strospeside, 16-formate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

BRN 0072010 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 734.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.5 mmHg at 25°C
Enthalpy of Vaporization: 122.4±6.0 kJ/mol
Flash Point: 233.7±26.4 °C
Index of Refraction: 1.582
Molar Refractivity: 146.6±0.4 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 2.90
ACD/LogD (pH 5.5): 2.04
ACD/BCF (pH 5.5): 21.05
ACD/KOC (pH 5.5): 308.22
ACD/LogD (pH 7.4): 2.04
ACD/BCF (pH 7.4): 21.05
ACD/KOC (pH 7.4): 308.22
Polar Surface Area: 141 Å2
Polarizability: 58.1±0.5 10-24cm3
Surface Tension: 58.1±5.0 dyne/cm
Molar Volume: 439.1±5.0 cm3

Click to predict properties on the Chemicalize site


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