ChemSpider 2D Image | (1S)-Hexopyranosyl-(1->2)-[(1S)-hexopyranosyl-(1->3)]-1-O-[(8alpha,9beta,10alpha,13alpha)-13-{[(1S)-hexopyranosyl-(1->2)-[(1S)-hexopyranosyl-(1->3)]-(1S)hexopyranosyl]oxy}-18-oxokaur-16-en-18-yl]hexop yranose | C56H90O33

(1S)-Hexopyranosyl-(1->2)-[(1S)-hexopyranosyl-(1->3)]-1-O-[(8α,9β,10α,13α)-13-{[(1S)-hexopyranosyl-(1->2)-[(1S)-hexopyranosyl-(1->3)]-(1S)hexopyranosyl]oxy}-18-oxokaur-16-en-18-yl]hexop yranose

  • Molecular FormulaC56H90O33
  • Average mass1291.294 Da
  • Monoisotopic mass1290.536377 Da
  • ChemSpider ID95642088

  • defined stereocentres - 11 of 36 defined stereocentres

More details:

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

(1S)-Hexopyranosyl-(1->2)-[(1S)-hexopyranosyl-(1->3)]-1-O-[(8α,9β,10α,13α)-13-{[(1S)-hexopyranosyl-(1->2)-[(1S)-hexopyranosyl-(1->3)]-(1S)hexopyranosyl]oxy}-18-oxokaur-16-en-18-yl]hexop yranose [German] [ACD/IUPAC Name]
(1S)-Hexopyranosyl-(1->2)-[(1S)-hexopyranosyl-(1->3)]-1-O-[(8α,9β,10α,13α)-13-{[(1S)-hexopyranosyl-(1->2)-[(1S)-hexopyranosyl-(1->3)]-(1S)hexopyranosyl]oxy}-18-oxokaur-16-en-18-yl]hexop yranose [ACD/IUPAC Name]
(1S)-Hexopyranosyl-(1->2)-[(1S)-hexopyranosyl-(1->3)]-1-O-[(8α,9β,10α,13α)-13-{[(1S)-hexopyranosyl-(1->2)-[(1S)-hexopyranosyl-(1->3)]-(1S)hexopyranosyl]oxy}-18-oxokaur-16-én-18-yl]hexop yranose [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.678
Molar Refractivity: 291.5±0.4 cm3
#H bond acceptors: 33
#H bond donors: 20
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 3
ACD/LogP: -5.72
ACD/LogD (pH 5.5): -5.77
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 532 Å2
Polarizability: 115.6±0.5 10-24cm3
Surface Tension: 105.0±5.0 dyne/cm
Molar Volume: 772.9±5.0 cm3

Click to predict properties on the Chemicalize site


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