Found 41 results

Search term: MF = 'C_{36}H_{54}O_{10}'
ChemSpider 2D Image | (3beta,11alpha,12alpha,17alpha)-28-Oxo-11,12:13,28-diepoxyoleanan-3-yl beta-D-glucopyranosiduronic acid | C36H54O10

(3β,11α,12α,17α)-28-Oxo-11,12:13,28-diepoxyoleanan-3-yl β-D-glucopyranosiduronic acid

  • Molecular FormulaC36H54O10
  • Average mass646.808 Da
  • Monoisotopic mass646.371704 Da
  • ChemSpider ID10167045

  • defined stereocentres - 16 of 16 defined stereocentres

More details:

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

(3β,11α,12α,17α)-28-Oxo-11,12:13,28-diepoxyoleanan-3-yl β-D-glucopyranosiduronic acid [ACD/IUPAC Name]
(3β,11α,12α,17α)-28-Oxo-11,12:13,28-diepoxyoleanan-3-yl-β-D-glucopyranosiduronsäure [German] [ACD/IUPAC Name]
Acide β-D-glucopyranosiduronique de (3β,11α,12α,17α)-28-oxo-11,12:13,28-diépoxyoléanan-3-yle [French] [ACD/IUPAC Name]
Oleanan-28-one, 11,12:13,28-diepoxy-3-(β-D-glucopyranuronosyloxy)-, (3β,11α,12α,17α)- [ACD/Index Name]
11-α,12-α-epoxy-3-β-[(O-β-D-glucuronopyranosyl)oxy]olean-28,13-olide

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.604
Molar Refractivity: 165.6±0.4 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: 4.31
ACD/LogD (pH 5.5): 1.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.02
ACD/LogD (pH 7.4): 0.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 155 Å2
Polarizability: 65.6±0.5 10-24cm3
Surface Tension: 61.5±5.0 dyne/cm
Molar Volume: 481.3±5.0 cm3

Click to predict properties on the Chemicalize site


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