ChemSpider 2D Image | 6-Deoxy-beta-L-mannopyranosyl-(1->3)-beta-D-xylopyranosyl-(1->4)-6-deoxy-L-mannopyranosyl-(1->2)-1-O-[(3beta,16alpha,18alpha)-3-(beta-D-glucopyranosyloxy)-16-hydroxy-28-oxoolean-12-en-28-yl]-alpha-D-x ylopyranose | C58H94O25

6-Deoxy-β-L-mannopyranosyl-(1->3)-β-D-xylopyranosyl-(1->4)-6-deoxy-L-mannopyranosyl-(1->2)-1-O-[(3β,16α,18α)-3-(β-D-glucopyranosyloxy)-16-hydroxy-28-oxoolean-12-en-28-yl]-α-D-x ylopyranose

  • Molecular FormulaC58H94O25
  • Average mass1191.352 Da
  • Monoisotopic mass1190.608398 Da
  • ChemSpider ID111319137

  • defined stereocentres - 31 of 32 defined stereocentres

More details:

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

6-Deoxy-β-L-mannopyranosyl-(1->3)-β-D-xylopyranosyl-(1->4)-6-deoxy-L-mannopyranosyl-(1->2)-1-O-[(3β,16α,18α)-3-(β-D-glucopyranosyloxy)-16-hydroxy-28-oxoolean-12-en-28-yl]-α-D-x ylopyranose [ACD/IUPAC Name]
6-Desoxy-β-L-mannopyranosyl-(1->3)-β-D-xylopyranosyl-(1->4)-6-desoxy-L-mannopyranosyl-(1->2)-1-O-[(3β,16α,18α)-3-(β-D-glucopyranosyloxy)-16-hydroxy-28-oxoolean-12-en-28-yl]-α-D -xylopyranose [German] [ACD/IUPAC Name]
6-Désoxy-β-L-mannopyranosyl-(1->3)-β-D-xylopyranosyl-(1->4)-6-désoxy-L-mannopyranosyl-(1->2)-1-O-[(3β,16α,18α)-3-(β-D-glucopyranosyloxy)-16-hydroxy-28-oxooléan-12-én-28-yl]-α-D -xylopyranose [French] [ACD/IUPAC Name]
α-D-Xylopyranose, O-6-deoxy-β-L-mannopyranosyl-(1->3)-O-β-D-xylopyranosyl-(1->4)-O-6-deoxy-L-mannopyranosyl-(1->2)-1-O-[(3β,16α,18α)-3-(β-D-glucopyranosyloxy)-16-hydroxy-28-oxo olean-12-en-28-yl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.633
Molar Refractivity: 288.3±0.4 cm3
#H bond acceptors: 25
#H bond donors: 14
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 4.33
ACD/LogD (pH 5.5): 2.69
ACD/BCF (pH 5.5): 64.90
ACD/KOC (pH 5.5): 689.49
ACD/LogD (pH 7.4): 2.69
ACD/BCF (pH 7.4): 64.90
ACD/KOC (pH 7.4): 689.49
Polar Surface Area: 393 Å2
Polarizability: 114.3±0.5 10-24cm3
Surface Tension: 79.5±5.0 dyne/cm
Molar Volume: 807.2±5.0 cm3

Click to predict properties on the Chemicalize site


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