ChemSpider 2D Image | (3beta,5alpha,6beta,7beta,16alpha)-3,6,7-Trihydroxycholest-8(14)-en-16-yl 6-O-methyl-3-O-(6-O-methyl-alpha-L-altrofuranosyl)-alpha-L-altrofuranoside | C41H70O14

(3β,5α,6β,7β,16α)-3,6,7-Trihydroxycholest-8(14)-en-16-yl 6-O-methyl-3-O-(6-O-methyl-α-L-altrofuranosyl)-α-L-altrofuranoside

  • Molecular FormulaC41H70O14
  • Average mass786.986 Da
  • Monoisotopic mass786.476563 Da
  • ChemSpider ID29214237
  • defined stereocentres - 20 of 20 defined stereocentres


More details:






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

(3β,5α,6β,7β,16α)-3,6,7-Trihydroxycholest-8(14)-en-16-yl 6-O-methyl-3-O-(6-O-methyl-α-L-altrofuranosyl)-α-L-altrofuranoside [ACD/IUPAC Name]
(3β,5α,6β,7β,16α)-3,6,7-Trihydroxycholest-8(14)-en-16-yl-6-O-methyl-3-O-(6-O-methyl-α-L-altrofuranosyl)-α-L-altrofuranosid [German] [ACD/IUPAC Name]
6-O-Méthyl-3-O-(6-O-méthyl-α-L-altrofuranosyl)-α-L-altrofuranoside de (3β,5α,6β,7β,16α)-3,6,7-trihydroxycholest-8(14)-én-16-yle [French] [ACD/IUPAC Name]
α-L-Altrofuranoside, (3β,5α,6β,7β,16α)-3,6,7-trihydroxycholest-8(14)-en-16-yl 6-O-methyl-3-O-(6-O-methyl-α-L-altrofuranosyl)- [ACD/Index Name]
anthenoside D

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 902.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 149.0±6.0 kJ/mol
Flash Point: 499.6±34.3 °C
Index of Refraction: 1.584
Molar Refractivity: 201.4±0.4 cm3
#H bond acceptors: 14
#H bond donors: 8
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: 4.94
ACD/LogD (pH 5.5): 3.67
ACD/BCF (pH 5.5): 361.36
ACD/KOC (pH 5.5): 2358.19
ACD/LogD (pH 7.4): 3.67
ACD/BCF (pH 7.4): 361.36
ACD/KOC (pH 7.4): 2358.17
Polar Surface Area: 217 Å2
Polarizability: 79.8±0.5 10-24cm3
Surface Tension: 61.9±5.0 dyne/cm
Molar Volume: 601.7±5.0 cm3

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