ChemSpider 2D Image | dTDP-4-amino-4,6-dideoxy-5-C-methyl-L-mannose | C17H29N3O14P2

dTDP-4-amino-4,6-dideoxy-5-C-methyl-L-mannose

  • Molecular FormulaC17H29N3O14P2
  • Average mass561.371 Da
  • Monoisotopic mass561.112488 Da
  • ChemSpider ID391482

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(2R,3R,4R,5S)-5-Amino-3,4-dihydroxy-6,6-dimethyltetrahydro-2H-pyran-2-yl [(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)tetrahydro-2-furanyl]methyl dihydrogen diphosphate (n on-preferred name) [ACD/IUPAC Name]
(2R,3R,4R,5S)-5-Amino-3,4-dihydroxy-6,6-dimethyltetrahydro-2H-pyran-2-yl-[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)tetrahydro-2-furanyl]methyldihydrogendiphosphat (non- preferred name) [German] [ACD/IUPAC Name]
Dihydrogénodiphosphate de (2R,3R,4R,5S)-5-amino-3,4-dihydroxy-6,6-diméthyltétrahydro-2H-pyran-2-yle et de [(2R,3S,5R)-3-hydroxy-5-(5-méthyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)tétrahydro-2-furanyl ]méthyle [French] [ACD/IUPAC Name]
dTDP-4-amino-4,6-dideoxy-5-C-methyl-L-mannose

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

C11461 [DBID]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.619
Molar Refractivity: 115.4±0.4 cm3
#H bond acceptors: 17
#H bond donors: 8
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: -3.43
ACD/LogD (pH 5.5): -8.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 276 Å2
Polarizability: 45.8±0.5 10-24cm3
Surface Tension: 89.5±5.0 dyne/cm
Molar Volume: 329.2±5.0 cm3

Click to predict properties on the Chemicalize site


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