ChemSpider 2D Image | (3beta,22S,25R)-17-Hydroxyspirost-5-en-3-yl 6-deoxy-alpha-L-mannopyranosyl-(1->2)-[beta-D-xylopyranosyl-(1->4)]-beta-D-glucopyranoside | C44H70O17

(3β,22S,25R)-17-Hydroxyspirost-5-en-3-yl 6-deoxy-α-L-mannopyranosyl-(1->2)-[β-D-xylopyranosyl-(1->4)]-β-D-glucopyranoside

  • Molecular FormulaC44H70O17
  • Average mass871.016 Da
  • Monoisotopic mass870.461304 Da
  • ChemSpider ID44750660

  • defined stereocentres - 25 of 25 defined stereocentres

More details:

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

(3β,22S,25R)-17-Hydroxyspirost-5-en-3-yl 6-deoxy-α-L-mannopyranosyl-(1->2)-[β-D-xylopyranosyl-(1->4)]-β-D-glucopyranoside [ACD/IUPAC Name]
(3β,22S,25R)-17-Hydroxyspirost-5-en-3-yl-6-desoxy-α-L-mannopyranosyl-(1->2)-[β-D-xylopyranosyl-(1->4)]-β-D-glucopyranosid [German] [ACD/IUPAC Name]
6-Désoxy-α-L-mannopyranosyl-(1->2)-[β-D-xylopyranosyl-(1->4)]-β-D-glucopyranoside de (3β,22S,25R)-17-hydroxyspirost-5-én-3-yle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, (3β,22S,25R)-17-hydroxyspirost-5-en-3-yl O-6-deoxy-α-L-mannopyranosyl-(1->2)-O-[β-D-xylopyranosyl-(1->4)]- [ACD/Index Name]
1029017-75-1 [RN]
102901-77-9 [RN]
17-Hydroxy sprengerinin C
3-O-α-L-rhamnopyranosyl-(12)-β-D-xylopyranosyl-(14)-β-D-glucopyranoside
pennogenin

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: 7
#Rule of 5 Violations: 4
ACD/LogP: 6.11
ACD/LogD (pH 5.5): 4.43
ACD/BCF (pH 5.5): 1373.61
ACD/KOC (pH 5.5): 6129.19
ACD/LogD (pH 7.4): 4.43
ACD/BCF (pH 7.4): 1373.60
ACD/KOC (pH 7.4): 6129.16
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


Advertisement