ChemSpider 2D Image | (3beta,11alpha,16beta)-9,11,16-Trihydroxyergosta-5,24(28)-dien-3-yl 6-deoxy-alpha-L-galactopyranoside | C34H56O8

(3β,11α,16β)-9,11,16-Trihydroxyergosta-5,24(28)-dien-3-yl 6-deoxy-α-L-galactopyranoside

  • Molecular FormulaC34H56O8
  • Average mass592.804 Da
  • Monoisotopic mass592.397522 Da
  • ChemSpider ID29216401

  • defined stereocentres - 15 of 15 defined stereocentres

More details:

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

(3β,11α,16β)-9,11,16-Trihydroxyergosta-5,24(28)-dien-3-yl 6-deoxy-α-L-galactopyranoside [ACD/IUPAC Name]
(3β,11α,16β)-9,11,16-Trihydroxyergosta-5,24(28)-dien-3-yl-6-desoxy-α-L-galactopyranosid [German] [ACD/IUPAC Name]
6-Désoxy-α-L-galactopyranoside de (3β,11α,16β)-9,11,16-trihydroxyergosta-5,24(28)-dién-3-yle [French] [ACD/IUPAC Name]
α-L-Galactopyranoside, (3β,11α,16β)-9,11,16-trihydroxyergosta-5,24(28)-dien-3-yl 6-deoxy- [ACD/Index Name]
24-methylenecholest-5-en-tetraol

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

Density: 1.2±0.1 g/cm3
Boiling Point: 703.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.1 mmHg at 25°C
Enthalpy of Vaporization: 117.6±6.0 kJ/mol
Flash Point: 379.0±32.9 °C
Index of Refraction: 1.581
Molar Refractivity: 160.9±0.4 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: 5.40
ACD/LogD (pH 5.5): 4.05
ACD/BCF (pH 5.5): 705.73
ACD/KOC (pH 5.5): 3807.64
ACD/LogD (pH 7.4): 4.05
ACD/BCF (pH 7.4): 705.72
ACD/KOC (pH 7.4): 3807.62
Polar Surface Area: 140 Å2
Polarizability: 63.8±0.5 10-24cm3
Surface Tension: 55.8±5.0 dyne/cm
Molar Volume: 482.6±5.0 cm3

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