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ChemSpider 2D Image | (5beta)-12-Hydroxy-20-[(6-O-pentofuranosylhexopyranosyl)oxy]dammar-24-en-3-yl 2-O-hexopyranosylhexopyranoside | C53H90O22

(5β)-12-Hydroxy-20-[(6-O-pentofuranosylhexopyranosyl)oxy]dammar-24-en-3-yl 2-O-hexopyranosylhexopyranoside

  • Molecular FormulaC53H90O22
  • Average mass1079.269 Da
  • Monoisotopic mass1078.592407 Da
  • ChemSpider ID78432258

  • defined stereocentres - 8 of 29 defined stereocentres

More details:

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

(5β)-12-Hydroxy-20-[(6-O-pentofuranosylhexopyranosyl)oxy]dammar-24-en-3-yl 2-O-hexopyranosylhexopyranoside [ACD/IUPAC Name]
(5β)-12-Hydroxy-20-[(6-O-pentofuranosylhexopyranosyl)oxy]dammar-24-en-3-yl-2-O-hexopyranosylhexopyranosid [German] [ACD/IUPAC Name]
2-O-Hexopyranosylhexopyranoside de (5β)-12-hydroxy-20-[(6-O-pentofuranosylhexopyranosyl)oxy]dammar-24-én-3-yle [French] [ACD/IUPAC Name]
Hexopyranoside, (5β)-12-hydroxy-20-[(6-O-pentofuranosylhexopyranosyl)oxy]dammar-24-en-3-yl 2-O-hexopyranosyl- [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: 1128.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 187.8±6.0 kJ/mol
Flash Point: 636.2±34.3 °C
Index of Refraction: 1.622
Molar Refractivity: 265.7±0.4 cm3
#H bond acceptors: 22
#H bond donors: 14
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 4
ACD/LogP: 5.10
ACD/LogD (pH 5.5): 2.00
ACD/BCF (pH 5.5): 19.65
ACD/KOC (pH 5.5): 293.13
ACD/LogD (pH 7.4): 2.00
ACD/BCF (pH 7.4): 19.65
ACD/KOC (pH 7.4): 293.13
Polar Surface Area: 357 Å2
Polarizability: 105.3±0.5 10-24cm3
Surface Tension: 76.6±5.0 dyne/cm
Molar Volume: 754.8±5.0 cm3

Click to predict properties on the Chemicalize site


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