ChemSpider 2D Image | (3beta,22R,25R)-3,22-Dihydroxyfurost-5-en-26-yl beta-D-erythro-hexopyranoside | C33H54O9

(3β,22R,25R)-3,22-Dihydroxyfurost-5-en-26-yl β-D-erythro-hexopyranoside

  • Molecular FormulaC33H54O9
  • Average mass594.776 Da
  • Monoisotopic mass594.376770 Da
  • ChemSpider ID7968648
  • defined stereocentres - 14 of 16 defined stereocentres


More details:






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

(3β,22R,25R)-3,22-Dihydroxyfurost-5-en-26-yl β-D-erythro-hexopyranoside [ACD/IUPAC Name]
(3β,22R,25R)-3,22-Dihydroxyfurost-5-en-26-yl-β-D-erythro-hexopyranosid [German] [ACD/IUPAC Name]
β-D-érythro-Hexopyranoside de (3β,22R,25R)-3,22-dihydroxyfurost-5-én-26-yle [French] [ACD/IUPAC Name]
β-D-erythro-Hexopyranoside, (3β,22β,25R)-3,22-dihydroxyfurost-5-en-26-yl [ACD/Index Name]
26-O-[β-D-glucopyranosyl]-25R-furostan-3β,22α,26-triol

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

LMST01070001 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 744.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.6 mmHg at 25°C
Enthalpy of Vaporization: 124.0±6.0 kJ/mol
Flash Point: 404.3±32.9 °C
Index of Refraction: 1.598
Molar Refractivity: 156.5±0.4 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 2.24
ACD/LogD (pH 5.5): 2.36
ACD/BCF (pH 5.5): 36.84
ACD/KOC (pH 5.5): 460.02
ACD/LogD (pH 7.4): 2.36
ACD/BCF (pH 7.4): 36.84
ACD/KOC (pH 7.4): 460.01
Polar Surface Area: 149 Å2
Polarizability: 62.0±0.5 10-24cm3
Surface Tension: 61.6±5.0 dyne/cm
Molar Volume: 458.5±5.0 cm3

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