ChemSpider 2D Image | (9xi)-Solanid-5-en-3-yl beta-D-galactopyranoside | C33H53NO6

(9ξ)-Solanid-5-en-3-yl β-D-galactopyranoside

  • Molecular FormulaC33H53NO6
  • Average mass559.777 Da
  • Monoisotopic mass559.387268 Da
  • ChemSpider ID4954782

  • defined stereocentres - 14 of 16 defined stereocentres

More details:

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

(9ξ)-Solanid-5-en-3-yl β-D-galactopyranoside [ACD/IUPAC Name]
(9ξ)-Solanid-5-en-3-yl-β-D-galactopyranosid [German] [ACD/IUPAC Name]
β-D-Galactopyranoside de (9ξ)-solanid-5-én-3-yle [French] [ACD/IUPAC Name]
β-D-Galactopyranoside, (9ξ)-solanid-5-en-3-yl [ACD/Index Name]
11017-45-1 [RN]
125-97-3 [RN]
20562-02-1 [RN]
32242-09-4 [RN]
4-21-00-01402 (Beilstein Handbook Reference) [Beilstein]
511-37-5 [RN]
More...

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

BRN 0077607 [DBID]
CCRIS 6507 [DBID]
HSDB 3539 [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: 682.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 114.5±6.0 kJ/mol
Flash Point: 366.5±31.5 °C
Index of Refraction: 1.604
Molar Refractivity: 153.4±0.4 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: 5.15
ACD/LogD (pH 5.5): 1.68
ACD/BCF (pH 5.5): 2.02
ACD/KOC (pH 5.5): 7.59
ACD/LogD (pH 7.4): 1.72
ACD/BCF (pH 7.4): 2.19
ACD/KOC (pH 7.4): 8.23
Polar Surface Area: 103 Å2
Polarizability: 60.8±0.5 10-24cm3
Surface Tension: 57.7±5.0 dyne/cm
Molar Volume: 445.8±5.0 cm3

Click to predict properties on the Chemicalize site


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