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Search term: ODAQLNCNDYUHGP (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-Hydroxy-6-methoxy-3-[(Z)-2-(3,4,5-trimethoxyphenyl)vinyl]phenyl 2,3,4,6-tetra-O-acetyl-beta-D-glucopyranoside | C32H38O15

2-Hydroxy-6-methoxy-3-[(Z)-2-(3,4,5-trimethoxyphenyl)vinyl]phenyl 2,3,4,6-tetra-O-acetyl-β-D-glucopyranoside

  • Molecular FormulaC32H38O15
  • Average mass662.635 Da
  • Monoisotopic mass662.221069 Da
  • ChemSpider ID9977185

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2,3,4,6-Tétra-O-acétyl-β-D-glucopyranoside de 2-hydroxy-6-méthoxy-3-[(Z)-2-(3,4,5-triméthoxyphényl)vinyl]phényle [French] [ACD/IUPAC Name]
2-Hydroxy-6-methoxy-3-[(Z)-2-(3,4,5-trimethoxyphenyl)vinyl]phenyl 2,3,4,6-tetra-O-acetyl-β-D-glucopyranoside [ACD/IUPAC Name]
2-Hydroxy-6-methoxy-3-[(Z)-2-(3,4,5-trimethoxyphenyl)vinyl]phenyl-2,3,4,6-tetra-O-acetyl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
β-D-Glucopyranoside, 2-hydroxy-6-methoxy-3-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl, tetraacetate [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 729.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.2±3.0 kJ/mol
Flash Point: 224.5±26.4 °C
Index of Refraction: 1.567
Molar Refractivity: 161.2±0.4 cm3
#H bond acceptors: 15
#H bond donors: 1
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 2
ACD/LogP: 4.97
ACD/LogD (pH 5.5): 3.47
ACD/BCF (pH 5.5): 256.54
ACD/KOC (pH 5.5): 1844.56
ACD/LogD (pH 7.4): 3.42
ACD/BCF (pH 7.4): 228.81
ACD/KOC (pH 7.4): 1645.18
Polar Surface Area: 181 Å2
Polarizability: 63.9±0.5 10-24cm3
Surface Tension: 57.1±5.0 dyne/cm
Molar Volume: 493.8±5.0 cm3

Click to predict properties on the Chemicalize site


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