Found 28 results

Search term: MF = 'C_{17}H_{26}N_{4}O_{11}'
ChemSpider 2D Image | (2R,3R,4S)-3-Acetamido-4-[({(2S)-1-[(carboxymethyl)amino]-1-oxo-2-propanyl}carbamoyl)amino]-2-[(1R,2R)-1,2,3-trihydroxypropyl]-3,4-dihydro-2H-pyran-6-carboxylic acid | C17H26N4O11

(2R,3R,4S)-3-Acetamido-4-[({(2S)-1-[(carboxymethyl)amino]-1-oxo-2-propanyl}carbamoyl)amino]-2-[(1R,2R)-1,2,3-trihydroxypropyl]-3,4-dihydro-2H-pyran-6-carboxylic acid

  • Molecular FormulaC17H26N4O11
  • Average mass462.409 Da
  • Monoisotopic mass462.159821 Da
  • ChemSpider ID28519592

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(2R,3R,4S)-3-Acetamido-4-[({(2S)-1-[(carboxymethyl)amino]-1-oxo-2-propanyl}carbamoyl)amino]-2-[(1R,2R)-1,2,3-trihydroxypropyl]-3,4-dihydro-2H-pyran-6-carbonsäure [German] [ACD/IUPAC Name]
(2R,3R,4S)-3-Acetamido-4-[({(2S)-1-[(carboxymethyl)amino]-1-oxo-2-propanyl}carbamoyl)amino]-2-[(1R,2R)-1,2,3-trihydroxypropyl]-3,4-dihydro-2H-pyran-6-carboxylic acid [ACD/IUPAC Name]
Acide (2R,3R,4S)-3-acétamido-4-[({(2S)-1-[(carboxyméthyl)amino]-1-oxo-2-propanyl}carbamoyl)amino]-2-[(1R,2R)-1,2,3-trihydroxypropyl]-3,4-dihydro-2H-pyrane-6-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 1096.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 182.2±6.0 kJ/mol
Flash Point: 617.2±34.3 °C
Index of Refraction: 1.616
Molar Refractivity: 102.9±0.4 cm3
#H bond acceptors: 15
#H bond donors: 9
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: -4.49
ACD/LogD (pH 5.5): -7.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.87
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 244 Å2
Polarizability: 40.8±0.5 10-24cm3
Surface Tension: 86.6±5.0 dyne/cm
Molar Volume: 294.2±5.0 cm3

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