ChemSpider 2D Image | 1-[2,7-bis({2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]ethynyl})spiro[fluorene-9,4'-piperidin]-1'-yl]ethanone | C35H39NO11

1-[2,7-bis({2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]ethynyl})spiro[fluorene-9,4'-piperidin]-1'-yl]ethanone

  • Molecular FormulaC35H39NO11
  • Average mass649.684 Da
  • Monoisotopic mass649.252319 Da
  • ChemSpider ID32865431

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

1-(2,7-Bis{[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]ethinyl}-1'H-spiro[fluorene-9,4'-piperidin]-1'-yl)ethanon [German] [ACD/IUPAC Name]
1-(2,7-Bis{[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]ethynyl}-1'H-spiro[fluorene-9,4'-piperidin]-1'-yl)ethanone [ACD/IUPAC Name]
1-(2,7-Bis{[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxyméthyl)tétrahydro-2H-pyran-2-yl]éthynyl}-1'H-spiro[fluorene-9,4'-piperidin]-1'-yl)éthanone [French] [ACD/IUPAC Name]
1-[2,7-bis({2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]ethynyl})spiro[fluorene-9,4'-piperidin]-1'-yl]ethan-1-one
1-[2,7-bis({2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]ethynyl})spiro[fluorene-9,4'-piperidin]-1'-yl]ethanone
1616113-45-1 [RN]
1-(2,7-bis(((2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)ethynyl)spiro[fluorene-9,4'-piperidin]-1'-yl)ethan-1-one
1-[2,7-Bis({2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]ethynyl})spiro[fluorene-9,4'-piperidine]-1'-yl]ethan-1-one
1-[2,7-bis[2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]ethynyl]spiro[fluorene-9,4'-piperidine]-1'-yl]ethanone
1-[2,7-bis[2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]ethynyl]spiro[fluorene-9,4'-piperidine]-1'-yl]ethanone
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  • Miscellaneous

    • Bio Activity:

      Antibacterial MedChem Express HY-12820
      Antibiotic-202 is an antibiotic compound, for treating bacterial infections. ;Target: AntibacterialAntibiotic-202 is useful for the treatment or prevention of bacteria infections. MedChem Express HY-12820
      Anti-infection; MedChem Express HY-12820

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

Density: 1.6±0.1 g/cm3
Boiling Point: 993.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 151.8±3.0 kJ/mol
Flash Point: 554.7±34.3 °C
Index of Refraction: 1.735
Molar Refractivity: 165.4±0.4 cm3
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: 4.01
ACD/LogD (pH 5.5): 2.60
ACD/BCF (pH 5.5): 55.45
ACD/KOC (pH 5.5): 616.05
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 55.45
ACD/KOC (pH 7.4): 616.04
Polar Surface Area: 201 Å2
Polarizability: 65.6±0.5 10-24cm3
Surface Tension: 102.9±5.0 dyne/cm
Molar Volume: 412.1±5.0 cm3

Click to predict properties on the Chemicalize site


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