ChemSpider 2D Image | 12-Hydroxy-18-oxo-18,20-epoxylanost-9(11)-en-3-yl 6-deoxyhexopyranosyl-(1->2)-[3-O-methylhexopyranosyl-(1->3)hexopyranosyl-(1->4)]pentopyranoside | C54H88O22

12-Hydroxy-18-oxo-18,20-epoxylanost-9(11)-en-3-yl 6-deoxyhexopyranosyl-(1->2)-[3-O-methylhexopyranosyl-(1->3)hexopyranosyl-(1->4)]pentopyranoside

  • Molecular FormulaC54H88O22
  • Average mass1089.263 Da
  • Monoisotopic mass1088.576782 Da
  • ChemSpider ID138234

More details:

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

12-Hydroxy-18-oxo-18,20-epoxylanost-9(11)-en-3-yl 6-deoxyhexopyranosyl-(1->2)-[3-O-methylhexopyranosyl-(1->3)hexopyranosyl-(1->4)]pentopyranoside [ACD/IUPAC Name]
12-Hydroxy-18-oxo-18,20-epoxylanost-9(11)-en-3-yl6-desoxyhexopyranosyl-(1->2)-[3-O-methylhexopyranosyl-(1->3)hexopyranosyl-(1->4)]pentopyranosid [German] [ACD/IUPAC Name]
6-Désoxyhexopyranosyl-(1->2)-[3-O-méthylhexopyranosyl-(1->3)hexopyranosyl-(1->4)]pentopyranoside de 12-hydroxy-18-oxo-18,20-époxylanost-9(11)-én-3-yle [French] [ACD/IUPAC Name]
Lanost-9(11)-en-18-one, 3-[[O--6-deoxyhexopyranosyl-(1->2)-O-[O--3-O-methylhexopyranosyl-(1->3)hexopyranosyl-(1->4)]pentopyranosyl]oxy]-18,20-epoxy-12-hydroxy- [ACD/Index Name]
77394-04-8 [RN]
LANOST-9(11)-EN-18-OIC ACID,3-[(O-6-DEOXY-D-GLUCOPYRANOSYL- (1F2)-O-[O-3-O-METHYL-DGLUCOPYRANOSYL-( 1F3)-D-GLUCOPYRANOSYL- (1F4)]-D-XYLOPYRANOSYL)OXY]-12,20- DIHYDROXY-,LACTONE,(312R)-

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: 1.612
Molar Refractivity: 267.3±0.4 cm3
#H bond acceptors: 22
#H bond donors: 11
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 4
ACD/LogP: 7.97
ACD/LogD (pH 5.5): 6.02
ACD/BCF (pH 5.5): 22061.96
ACD/KOC (pH 5.5): 44718.67
ACD/LogD (pH 7.4): 6.02
ACD/BCF (pH 7.4): 22061.84
ACD/KOC (pH 7.4): 44718.42
Polar Surface Area: 332 Å2
Polarizability: 106.0±0.5 10-24cm3
Surface Tension: 71.8±5.0 dyne/cm
Molar Volume: 768.9±5.0 cm3

Click to predict properties on the Chemicalize site


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