ChemSpider 2D Image | (8xi,9xi,10xi,13xi,14xi,16xi,17xi)-Solanid-5-en-3-yl 6-deoxy-beta-L-mannopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->3)]-beta-D-galactopyranoside | C45H73NO15

(8ξ,9ξ,10ξ,13ξ,14ξ,16ξ,17ξ)-Solanid-5-en-3-yl 6-deoxy-β-L-mannopyranosyl-(1->2)-[β-D-glucopyranosyl-(1->3)]-β-D-galactopyranoside

  • Molecular FormulaC45H73NO15
  • Average mass868.059 Da
  • Monoisotopic mass867.498047 Da
  • ChemSpider ID22889373

  • defined stereocentres - 18 of 26 defined stereocentres

More details:

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

(8ξ,9ξ,10ξ,13ξ,14ξ,16ξ,17ξ)-Solanid-5-en-3-yl 6-deoxy-β-L-mannopyranosyl-(1->2)-[β-D-glucopyranosyl-(1->3)]-β-D-galactopyranoside [ACD/IUPAC Name]
(8ξ,9ξ,10ξ,13ξ,14ξ,16ξ,17ξ)-Solanid-5-en-3-yl-6-desoxy-β-L-mannopyranosyl-(1->2)-[β-D-glucopyranosyl-(1->3)]-β-D-galactopyranosid [German] [ACD/IUPAC Name]
6-Désoxy-β-L-mannopyranosyl-(1->2)-[β-D-glucopyranosyl-(1->3)]-β-D-galactopyranoside de (8ξ,9ξ,10ξ,13ξ,14ξ,16ξ,17ξ)-solanid-5-én-3-yle [French] [ACD/IUPAC Name]
β-D-Galactopyranoside, (8ξ,9ξ,10ξ,13ξ,14ξ,16ξ,17ξ)-solanid-5-en-3-yl O-6-deoxy-β-L-mannopyranosyl-(1->2)-O-[β-D-glucopyranosyl-(1->3)]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.631
Molar Refractivity: 219.4±0.4 cm3
#H bond acceptors: 16
#H bond donors: 9
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 4
ACD/LogP: 5.67
ACD/LogD (pH 5.5): 1.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.29
ACD/LogD (pH 7.4): 1.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.66
Polar Surface Area: 241 Å2
Polarizability: 87.0±0.5 10-24cm3
Surface Tension: 72.5±5.0 dyne/cm
Molar Volume: 615.7±5.0 cm3

Click to predict properties on the Chemicalize site


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