ChemSpider 2D Image | (3beta,9beta,10alpha,13alpha,17beta,22S,25R)-17-Hydroxyspirost-5-en-3-yl 6-deoxy-beta-L-glucopyranosyl-(1->2)-[beta-L-ribofuranosyl-(1->4)]-alpha-D-mannopyranoside | C44H70O17

(3β,9β,10α,13α,17β,22S,25R)-17-Hydroxyspirost-5-en-3-yl 6-deoxy-β-L-glucopyranosyl-(1->2)-[β-L-ribofuranosyl-(1->4)]-α-D-mannopyranoside

  • Molecular FormulaC44H70O17
  • Average mass871.016 Da
  • Monoisotopic mass870.461304 Da
  • ChemSpider ID113609191

  • defined stereocentres - 25 of 25 defined stereocentres

More details:

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

(3β,9β,10α,13α,17β,22S,25R)-17-Hydroxyspirost-5-en-3-yl 6-deoxy-β-L-glucopyranosyl-(1->2)-[β-L-ribofuranosyl-(1->4)]-α-D-mannopyranoside [ACD/IUPAC Name]
(3β,9β,10α,13α,17β,22S,25R)-17-Hydroxyspirost-5-en-3-yl-6-desoxy-β-L-glucopyranosyl-(1->2)-[β-L-ribofuranosyl-(1->4)]-α-D-mannopyranosid [German] [ACD/IUPAC Name]
6-Désoxy-β-L-glucopyranosyl-(1->2)-[β-L-ribofuranosyl-(1->4)]-α-D-mannopyranoside de (3β,9β,10α,13α,17β,22S,25R)-17-hydroxyspirost-5-én-3-yle [French] [ACD/IUPAC Name]
α-D-Mannopyranoside, (3β,9β,10α,13α,17β,22S,25R)-17-hydroxyspirost-5-en-3-yl O-6-deoxy-β-L-glucopyranosyl-(1->2)-O-[β-L-ribofuranosyl-(1->4)]- [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.628
Molar Refractivity: 214.4±0.4 cm3
#H bond acceptors: 17
#H bond donors: 9
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 4
ACD/LogP: 6.31
ACD/LogD (pH 5.5): 4.55
ACD/BCF (pH 5.5): 1680.14
ACD/KOC (pH 5.5): 7079.81
ACD/LogD (pH 7.4): 4.55
ACD/BCF (pH 7.4): 1680.13
ACD/KOC (pH 7.4): 7079.77
Polar Surface Area: 256 Å2
Polarizability: 85.0±0.5 10-24cm3
Surface Tension: 73.6±5.0 dyne/cm
Molar Volume: 604.2±5.0 cm3

Click to predict properties on the Chemicalize site


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