ChemSpider 2D Image | 2-(Dimethylamino)-4-hydroxy-6-(hydroxymethyl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazol-5-yl 2-acetamido-4-O-(2-acetamido-2-deoxyhexopyranosyl)-2-deoxyhexopyranoside | C25H42N4O14

2-(Dimethylamino)-4-hydroxy-6-(hydroxymethyl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazol-5-yl 2-acetamido-4-O-(2-acetamido-2-deoxyhexopyranosyl)-2-deoxyhexopyranoside

  • Molecular FormulaC25H42N4O14
  • Average mass622.619 Da
  • Monoisotopic mass622.269775 Da
  • ChemSpider ID10670675

More details:

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

2-(dimethylamino)-4-hydroxy-6-(hydroxymethyl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazol-5-yl 2-(acetylamino)-4-O-[2-(acetylamino)-2-deoxyhexopyranosyl]-2-deoxyhexopyranoside
2-(Dimethylamino)-4-hydroxy-6-(hydroxymethyl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazol-5-yl 2-acetamido-4-O-(2-acetamido-2-deoxyhexopyranosyl)-2-deoxyhexopyranoside [ACD/IUPAC Name]
2-(Dimethylamino)-4-hydroxy-6-(hydroxymethyl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazol-5-yl-2-acetamido-4-O-(2-acetamido-2-desoxyhexopyranosyl)-2-desoxyhexopyranosid [German] [ACD/IUPAC Name]
2-Acétamido-4-O-(2-acétamido-2-désoxyhexopyranosyl)-2-désoxyhexopyranoside de 2-(diméthylamino)-4-hydroxy-6-(hydroxyméthyl)-4,5,6,6a-tétrahydro-3aH-cyclopenta[d][1,3]oxazol-5-yle [French] [ACD/IUPAC Name]
Hexopyranoside, 2-(dimethylamino)-3a,5,6,6a-tetrahydro-4-hydroxy-6-(hydroxymethyl)-4H-cyclopent[d]oxazol-5-yl 2-(acetylamino)-4-O-[2-(acetylamino)-2-deoxyhexopyranosyl]-2-deoxy- [ACD/Index Name]
N-{2-[5-Acetylamino-6-(2-dimethylamino-4-hydroxy-6-hydroxymethyl-4,5,6,6a-tetrahydro-3aH-cyclopentaoxazol-5-yloxy)-4-hydroxy-2-hydroxymethyl-tetrahydro-pyran-3-yloxy]-4,5-dihydroxy-6-hydroxymethyl-tetrahydro-pyran-3-yl}-acetamide

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.697
Molar Refractivity: 134.6±0.5 cm3
#H bond acceptors: 18
#H bond donors: 9
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: -3.66
ACD/LogD (pH 5.5): -4.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.66
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 262 Å2
Polarizability: 53.3±0.5 10-24cm3
Surface Tension: 69.9±7.0 dyne/cm
Molar Volume: 349.5±7.0 cm3

Click to predict properties on the Chemicalize site


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