ChemSpider 2D Image | (2alpha,3beta,5alpha,22R,25R)-26-(beta-D-Glucopyranosyloxy)-2,22-dihydroxyfurostan-3-yl beta-D-glucopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->3)]-beta-D-glucopyranosyl-(1->4)-beta-D-galactopyranosyl
-(1->3)-beta-D-glucopyranoside | C63H106O35

(2α,3β,5α,22R,25R)-26-(β-D-Glucopyranosyloxy)-2,22-dihydroxyfurostan-3-yl β-D-glucopyranosyl-(1->2)-[β-D-glucopyranosyl-(1->3)]-β-D-glucopyranosyl-(1->4)-β-D-galactopyranosyl -(1->3)-β-D-glucopyranoside

  • Molecular FormulaC63H106O35
  • Average mass1423.495 Da
  • Monoisotopic mass1422.651489 Da
  • ChemSpider ID390455
  • defined stereocentres - 43 of 43 defined stereocentres


More details:






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

(2α,3β,5α,22R,25R)-26-(β-D-Glucopyranosyloxy)-2,22-dihydroxyfurostan-3-yl β-D-glucopyranosyl-(1->2)-[β-D-glucopyranosyl-(1->3)]-β-D-glucopyranosyl-(1->4)-β-D-galactopyranosyl 
-(1->3)-β-D-glucopyranoside [ACD/IUPAC Name]
(2α,3β,5α,22R,25R)-26-(β-D-Glucopyranosyloxy)-2,22-dihydroxyfurostan-3-yl-β-D-glucopyranosyl-(1->2)-[β-D-glucopyranosyl-(1->3)]-β-D-glucopyranosyl-(1->4)-β-D-galactopyranosyl 
-(1->3)-β-D-glucopyranosid [German] [ACD/IUPAC Name]
β-D-Glucopyranoside, (2α,3β,5α,22β,25R)-26-(β-D-glucopyranosyloxy)-2,22-dihydroxyfurostan-3-yl O-β-D-glucopyranosyl-(1->2)-O-[β-D-glucopyranosyl-(1->3)]-O-β-D-glucopyranos yl-(1->4)-O-β-D-galactopyranosyl-(1->3)- [ACD/Index Name]
β-D-Glucopyranosyl-(1->2)-[β-D-glucopyranosyl-(1->3)]-β-D-glucopyranosyl-(1->4)-β-D-galactopyranosyl-(1->3)-β-D-glucopyranoside de (2α,3β,5α,22R,25R)-26-(β-D-glucopyranosy 
loxy)-2,22-dihydroxyfurostan-3-yle [French] [ACD/IUPAC Name]
54999-56-3 [RN]
Capsicoside A

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

C08889 [DBID]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.667
Molar Refractivity: 326.9±0.4 cm3
#H bond acceptors: 35
#H bond donors: 22
#Freely Rotating Bonds: 22
#Rule of 5 Violations: 3
ACD/LogP: -5.84
ACD/LogD (pH 5.5): -6.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 565 Å2
Polarizability: 129.6±0.5 10-24cm3
Surface Tension: 100.0±5.0 dyne/cm
Molar Volume: 877.9±5.0 cm3

Click to predict properties on the Chemicalize site






Advertisement