ChemSpider 2D Image | Desulfated pervicoside C | C54H88O22

Desulfated pervicoside C

  • Molecular FormulaC54H88O22
  • Average mass1089.263 Da
  • Monoisotopic mass1088.576782 Da
  • ChemSpider ID10270563
  • defined stereocentres - 28 of 28 defined stereocentres


More details:






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

(3β,12α)-12-Hydroxy-18-oxo-18,20-epoxylanost-9(11)-en-3-yl 3-O-methyl-β-D-glucopyranosyl-(1->;3)-β-D-glucopyranosyl-(1->4)-6-deoxy-β-D-glucopyranosyl-(1->2)-β-D-xylopyranoside [ACD/IUPAC Name]
(3β,12α)-12-Hydroxy-18-oxo-18,20-epoxylanost-9(11)-en-3-yl-3-O-methyl-β-D-glucopyranosyl-(1->;3)-β-D-glucopyranosyl-(1->4)-6-desoxy-β-D-glucopyranosyl-(1->2)-β-D-xylopyranosid [German] [ACD/IUPAC Name]
3-O-Méthyl-β-D-glucopyranosyl-(1->3)-β-D-glucopyranosyl-(1->4)-6-désoxy-β-D-glucopyranosyl-(1->2)-β-D-xylopyranoside de (3β,12α)-12-hydroxy-18-oxo-18,20-époxylanost-9(11)-én-3-yle [French] [ACD/IUPAC Name]
Desulfated pervicoside C
Lanost-9(11)-en-18-one, 18,20-epoxy-12-hydroxy-3-[[O-3-O-methyl-β-D-glucopyranosyl-(1->3)-O-β-D-glucopyranosyl-(1->4)-O-6-deoxy-β-D-glucopyranosyl-(1->2)-β-D-xylopyranosyl]oxy]-, (3β,12 α)- [ACD/Index Name]
DS-pervicoside C

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.612
Molar Refractivity: 267.3±0.4 cm3
#H bond acceptors: 22
#H bond donors: 11
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 4
ACD/LogP: 5.99
ACD/LogD (pH 5.5): 4.26
ACD/BCF (pH 5.5): 1022.63
ACD/KOC (pH 5.5): 4962.26
ACD/LogD (pH 7.4): 4.26
ACD/BCF (pH 7.4): 1022.63
ACD/KOC (pH 7.4): 4962.23
Polar Surface Area: 332 Å2
Polarizability: 106.0±0.5 10-24cm3
Surface Tension: 71.8±5.0 dyne/cm
Molar Volume: 768.9±5.0 cm3

Click to predict properties on the Chemicalize site






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