ChemSpider 2D Image | ciwujianoside C4 | C61H98O26

ciwujianoside C4

  • Molecular FormulaC61H98O26
  • Average mass1247.415 Da
  • Monoisotopic mass1246.634644 Da
  • ChemSpider ID10252134

  • defined stereocentres - 32 of 32 defined stereocentres

More details:

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

114906-75-1 [RN]
6-Deoxy-α-L-mannopyranosyl-(1->4)-6-O-acetyl-β-D-glucopyranosyl-(1->6)-1-O-[(3β)-3-{[2-O-(6-deoxy-α-L-mannopyranosyl)-α-L-arabinopyranosyl]oxy}-28-oxoolean-12-en-28-yl]-β-D-glucop yranose [ACD/IUPAC Name]
6-Desoxy-α-L-mannopyranosyl-(1->4)-6-O-acetyl-β-D-glucopyranosyl-(1->6)-1-O-[(3β)-3-{[2-O-(6-desoxy-α-L-mannopyranosyl)-α-L-arabinopyranosyl]oxy}-28-oxoolean-12-en-28-yl]-β-D-gluc opyranose [German] [ACD/IUPAC Name]
6-Désoxy-α-L-mannopyranosyl-(1->4)-6-O-acétyl-β-D-glucopyranosyl-(1->6)-1-O-[(3β)-3-{[2-O-(6-désoxy-α-L-mannopyranosyl)-α-L-arabinopyranosyl]oxy}-28-oxooléan-12-én-28-yl]-β-D-gluc opyranose [French] [ACD/IUPAC Name]
ciwujianoside C4
β-D-Glucopyranose, O-6-deoxy-α-L-mannopyranosyl-(1->4)-O-6-O-acetyl-β-D-glucopyranosyl-(1->6)-1-O-[(3β)-3-[[2-O-(6-deoxy-α-L-mannopyranosyl)-α-L-arabinopyranosyl]oxy]-28-oxoolean- 12-en-28-yl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.621
Molar Refractivity: 302.5±0.4 cm3
#H bond acceptors: 26
#H bond donors: 13
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 4
ACD/LogP: 7.01
ACD/LogD (pH 5.5): 4.16
ACD/BCF (pH 5.5): 857.27
ACD/KOC (pH 5.5): 4373.68
ACD/LogD (pH 7.4): 4.16
ACD/BCF (pH 7.4): 857.26
ACD/KOC (pH 7.4): 4373.65
Polar Surface Area: 399 Å2
Polarizability: 119.9±0.5 10-24cm3
Surface Tension: 75.9±5.0 dyne/cm
Molar Volume: 860.3±5.0 cm3

Click to predict properties on the Chemicalize site


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