ChemSpider 2D Image | (2alpha,3beta,5alpha,25R)-2,5-Dihydroxyspirostan-3-yl 6-deoxy-alpha-L-mannopyranosyl-(1->2)-[alpha-D-glucopyranosyl-(1->3)]-alpha-D-glucopyranoside | C45H74O19

(2α,3β,5α,25R)-2,5-Dihydroxyspirostan-3-yl 6-deoxy-α-L-mannopyranosyl-(1->2)-[α-D-glucopyranosyl-(1->3)]-α-D-glucopyranoside

  • Molecular FormulaC45H74O19
  • Average mass919.058 Da
  • Monoisotopic mass918.482422 Da
  • ChemSpider ID10163290
  • defined stereocentres - 28 of 28 defined stereocentres


More details:






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

(2α,3β,5α,25R)-2,5-Dihydroxyspirostan-3-yl 6-deoxy-α-L-mannopyranosyl-(1->;2)-[α-D-glucopyranosyl-(1->3)]-α-D-glucopyranoside [ACD/IUPAC Name]
(2α,3β,5α,25R)-2,5-Dihydroxyspirostan-3-yl-6-desoxy-α-L-mannopyranosyl-(1->2)-[α-D-glucopyranosyl-(1->3)]-α-D-glucopyranosid [German] [ACD/IUPAC Name]
6-Désoxy-α-L-mannopyranosyl-(1->2)-[α-D-glucopyranosyl-(1->3)]-α-D-glucopyranoside de (2α,3β,5α,25R)-2,5-dihydroxyspirostan-3-yle [French] [ACD/IUPAC Name]
α-D-Glucopyranoside, (2α,3β,5α,25R)-2,5-dihydroxyspirostan-3-yl O-6-deoxy-α-L-mannopyranosyl-(1->2)-O-[α-D-glucopyranosyl-(1->3)]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.632
Molar Refractivity: 222.4±0.4 cm3
#H bond acceptors: 19
#H bond donors: 11
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 2.29
ACD/LogD (pH 5.5): 1.37
ACD/BCF (pH 5.5): 6.42
ACD/KOC (pH 5.5): 131.68
ACD/LogD (pH 7.4): 1.37
ACD/BCF (pH 7.4): 6.42
ACD/KOC (pH 7.4): 131.68
Polar Surface Area: 296 Å2
Polarizability: 88.2±0.5 10-24cm3
Surface Tension: 78.3±5.0 dyne/cm
Molar Volume: 623.1±5.0 cm3

Click to predict properties on the Chemicalize site






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