Found 8 results

Search term: MF = 'C_{52}H_{84}O_{19}'
ChemSpider 2D Image | (3beta,18alpha)-3-{[6-Deoxy-alpha-L-mannopyranosyl-(1->3)-beta-D-xylopyranosyl-(1->3)-6-deoxy-alpha-L-mannopyranosyl-(1->2)-alpha-L-arabinopyranosyl]oxy}olean-12-en-28-oic acid | C52H84O19

(3β,18α)-3-{[6-Deoxy-α-L-mannopyranosyl-(1->3)-β-D-xylopyranosyl-(1->3)-6-deoxy-α-L-mannopyranosyl-(1->2)-α-L-arabinopyranosyl]oxy}olean-12-en-28-oic acid

  • Molecular FormulaC52H84O19
  • Average mass1013.212 Da
  • Monoisotopic mass1012.560669 Da
  • ChemSpider ID7987647

  • defined stereocentres - 26 of 26 defined stereocentres

More details:

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

(3β,18α)-3-{[6-Deoxy-α-L-mannopyranosyl-(1->3)-β-D-xylopyranosyl-(1->3)-6-deoxy-α-L-mannopyranosyl-(1->2)-α-L-arabinopyranosyl]oxy}olean-12-en-28-oic acid [ACD/IUPAC Name]
(3β,18α)-3-{[6-Desoxy-α-L-mannopyranosyl-(1->3)-β-D-xylopyranosyl-(1->3)-6-desoxy-α-L-mannopyranosyl-(1->2)-α-L-arabinopyranosyl]oxy}olean-12-en-28-säure [German] [ACD/IUPAC Name]
Acide (3β,18α)-3-{[6-désoxy-α-L-mannopyranosyl-(1->3)-β-D-xylopyranosyl-(1->3)-6-désoxy-α-L-mannopyranosyl-(1->2)-α-L-arabinopyranosyl]oxy}oléan-12-én-28-oïque [French] [ACD/IUPAC Name]
Olean-12-en-28-oic acid, 3-[[O-6-deoxy-α-L-mannopyranosyl-(1->3)-O-β-D-xylopyranosyl-(1->3)-O-6-deoxy-α-L-mannopyranosyl-(1->;2)-α-L-arabinopyranosyl]oxy]-, (3β,18α)- [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: 1.613
Molar Refractivity: 253.1±0.4 cm3
#H bond acceptors: 19
#H bond donors: 10
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 4
ACD/LogP: 10.54
ACD/LogD (pH 5.5): 6.76
ACD/BCF (pH 5.5): 48986.66
ACD/KOC (pH 5.5): 43400.43
ACD/LogD (pH 7.4): 4.96
ACD/BCF (pH 7.4): 771.74
ACD/KOC (pH 7.4): 683.73
Polar Surface Area: 293 Å2
Polarizability: 100.3±0.5 10-24cm3
Surface Tension: 70.0±5.0 dyne/cm
Molar Volume: 727.0±5.0 cm3

Click to predict properties on the Chemicalize site


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