ChemSpider 2D Image | 2-Deoxy-2-(trimethylammonio)-alpha-D-allopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-allopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-allopyranosyl-(1->4)-2-acetamido-2-deoxy-D-allopyranose | C33H59N4O20

2-Deoxy-2-(trimethylammonio)-α-D-allopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-allopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-allopyranosyl-(1->4)-2-acetamido-2-deoxy-D-allopyranose

  • Molecular FormulaC33H59N4O20
  • Average mass831.836 Da
  • Monoisotopic mass831.371704 Da
  • ChemSpider ID28285014

  • Charge - Charge

    defined stereocentres - 19 of 20 defined stereocentres

More details:

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

2-Deoxy-2-(trimethylammonio)-α-D-allopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-allopyranosyl-(1->4)-2-acetamido-2-deoxy-β-D-allopyranosyl-(1->4)-2-acetamido-2-deoxy-D-allopyranose [ACD/IUPAC Name]
2-Desoxy-2-(trimethylammonio)-α-D-allopyranosyl-(1->4)-2-acetamido-2-desoxy-β-D-allopyranosyl-(1->4)-2-acetamido-2-desoxy-β-D-allopyranosyl-(1->;4)-2-acetamido-2-desoxy-D-allopyranose [German] [ACD/IUPAC Name]
2-Désoxy-2-(triméthylammonio)-α-D-allopyranosyl-(1->4)-2-acétamido-2-désoxy-β-D-allopyranosyl-(1->4)-2-acétamido-2-désoxy-β-D-allopyranosyl-(1->;4)-2-acétamido-2-désoxy-D-allopyranose [French] [ACD/IUPAC Name]
D-Allopyranose, O-2-deoxy-2-(trimethylammonio)-α-D-allopyranosyl-(1->4)-O-2-(acetylamino)-2-deoxy-β-D-allopyranosyl-(1->4)-O-2-(acetylamino)-2-deoxy-β-D-allopyranosyl-(1->4)-2-(acetylamino)- 2-deoxy- [ACD/Index Name]
TMG-chitotriomycin

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
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Index of Refraction:
Molar Refractivity:
#H bond acceptors: 24
#H bond donors: 13
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: -6.11
ACD/LogD (pH 5.5): -6.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 354 Å2
Polarizability:
Surface Tension:
Molar Volume:

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