ChemSpider 2D Image | N-{[5-Methyl-3-(2-methyl-2-propanyl)-7-oxo-7H-furo[3,2-g]chromen-6-yl]acetyl}-D-tyrosine | C27H27NO7

N-{[5-Methyl-3-(2-methyl-2-propanyl)-7-oxo-7H-furo[3,2-g]chromen-6-yl]acetyl}-D-tyrosine

  • Molecular FormulaC27H27NO7
  • Average mass477.506 Da
  • Monoisotopic mass477.178741 Da
  • ChemSpider ID21834621

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

D-Tyrosine, N-[2-[3-(1,1-dimethylethyl)-5-methyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl]acetyl]- [ACD/Index Name]
N-{[5-Methyl-3-(2-methyl-2-propanyl)-7-oxo-7H-furo[3,2-g]chromen-6-yl]acetyl}-D-tyrosin [German] [ACD/IUPAC Name]
N-{[5-Methyl-3-(2-methyl-2-propanyl)-7-oxo-7H-furo[3,2-g]chromen-6-yl]acetyl}-D-tyrosine [ACD/IUPAC Name]
N-{2-[5-Méthyl-3-(2-méthyl-2-propanyl)-7-oxo-7H-furo[3,2-g]chromén-6-yl]acétyl}-D-tyrosine [French] [ACD/IUPAC Name]
(2R)-2-{2-[6-(tert-butyl)-4-methyl-2-oxofurano[3,2-g]chromen-3-yl]acetylamino}-3-(4-hydroxyphenyl)propanoic acid
(R)-2-(2-(3-(tert-butyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetamido)-3-(4-hydroxyphenyl)propanoic acid
1795787-15-3 [RN]
2-[2-(3-tert-Butyl-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)-acetylamino]-3-(4-hydroxy-phenyl)-propionic acid
N-[(3-tert-butyl-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]-D-tyrosine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 753.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 115.2±3.0 kJ/mol
Flash Point: 409.3±32.9 °C
Index of Refraction: 1.620
Molar Refractivity: 127.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.82
ACD/LogD (pH 5.5): 1.52
ACD/BCF (pH 5.5): 2.12
ACD/KOC (pH 5.5): 11.59
ACD/LogD (pH 7.4): 0.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 126 Å2
Polarizability: 50.6±0.5 10-24cm3
Surface Tension: 56.2±3.0 dyne/cm
Molar Volume: 363.8±3.0 cm3

Click to predict properties on the Chemicalize site


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