ChemSpider 2D Image | (1beta,3beta,25R)-3-Hydroxyspirost-5-en-1-yl 6-deoxy-alpha-L-mannopyranosyl-(1->2)-[beta-D-xylopyranosyl-(1->3)]-alpha-L-arabinopyranoside | C43H68O16

(1β,3β,25R)-3-Hydroxyspirost-5-en-1-yl 6-deoxy-α-L-mannopyranosyl-(1->2)-[β-D-xylopyranosyl-(1->3)]-α-L-arabinopyranoside

  • Molecular FormulaC43H68O16
  • Average mass840.990 Da
  • Monoisotopic mass840.450745 Da
  • ChemSpider ID9333822

  • defined stereocentres - 25 of 25 defined stereocentres

More details:

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

(1β,3β,25R)-3-Hydroxyspirost-5-en-1-yl 6-deoxy-α-L-mannopyranosyl-(1->2)-[β-D-xylopyranosyl-(1->3)]-α-L-arabinopyranoside [ACD/IUPAC Name]
(1β,3β,25R)-3-Hydroxyspirost-5-en-1-yl-6-desoxy-α-L-mannopyranosyl-(1->2)-[β-D-xylopyranosyl-(1->3)]-α-L-arabinopyranosid [German] [ACD/IUPAC Name]
6-Désoxy-α-L-mannopyranosyl-(1->2)-[β-D-xylopyranosyl-(1->3)]-α-L-arabinopyranoside de (1β,3β,25R)-3-hydroxyspirost-5-én-1-yle [French] [ACD/IUPAC Name]
α-L-Arabinopyranoside, (1β,3β,25R)-3-hydroxyspirost-5-en-1-yl O-6-deoxy-α-L-mannopyranosyl-(1->2)-O-[β-D-xylopyranosyl-(1->3)]- [ACD/Index Name]
(25R)-3[β]-Hydroxyspirost-5-en-1[β]-yl O-[α]-l-rhamnopyranosyl-(1[to]2)-O-[[β]-D-xylopyranosyl-(1[to]3)]-[α]-L-arabinopyranoside
790300-60-6 [RN]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL445238/

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: 1.622
Molar Refractivity: 208.2±0.4 cm3
#H bond acceptors: 16
#H bond donors: 8
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 4
ACD/LogP: 5.05
ACD/LogD (pH 5.5): 3.81
ACD/BCF (pH 5.5): 463.12
ACD/KOC (pH 5.5): 2816.47
ACD/LogD (pH 7.4): 3.81
ACD/BCF (pH 7.4): 463.11
ACD/KOC (pH 7.4): 2816.43
Polar Surface Area: 236 Å2
Polarizability: 82.5±0.5 10-24cm3
Surface Tension: 70.6±5.0 dyne/cm
Molar Volume: 591.4±5.0 cm3

Click to predict properties on the Chemicalize site


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