ChemSpider 2D Image | 1-O-({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E)-3,7,11,15,19,23,27,31,35,39-Decamethyl-2,6,10,14,18,22,26,30,34,38-tetracontadecaen-1-yl]oxy}phosphinato)-5-O-phosphonato-beta-D-ribofuranose | C55H89O11P2

1-O-({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E)-3,7,11,15,19,23,27,31,35,39-Decamethyl-2,6,10,14,18,22,26,30,34,38-tetracontadecaen-1-yl]oxy}phosphinato)-5-O-phosphonato-β-D-ribofuranose

  • Molecular FormulaC55H89O11P2
  • Average mass988.238 Da
  • Monoisotopic mass987.589661 Da
  • ChemSpider ID28533063

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1-O-({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E)-3,7,11,15,19,23,27,31,35,39-Decamethyl-2,6,10,14,18,22,26,30,34,38-tetracontadecaen-1-yl]oxy}phosphinato)-5-O-phosphonato-β-D-ribofuranose [German] [ACD/IUPAC Name]
1-O-({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E)-3,7,11,15,19,23,27,31,35,39-Decamethyl-2,6,10,14,18,22,26,30,34,38-tetracontadecaen-1-yl]oxy}phosphinato)-5-O-phosphonato-β-D-ribofuranose [ACD/IUPAC Name]
1-O-({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E)-3,7,11,15,19,23,27,31,35,39-Décaméthyl-2,6,10,14,18,22,26,30,34,38-tétracontadécaén-1-yl]oxy}phosphinato)-5-O-phosphonato-β-D-ribofuranose [French] [ACD/IUPAC Name]
β-D-Ribofuranose, 1-O-[[[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E)-3,7,11,15,19,23,27,31,35,39-decamethyl-2,6,10,14,18,22,26,30,34,38-tetracontadecaen-1-yl]oxy]hydroxyphosphinyl]-, 5-(dihydrogen phosphat e), ion(3-) [ACD/Index Name]
1-O-({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-yl]oxy}phosphinato)-5-O-phosphonato-β-D-ribofuranose
decaprenyl-phosphoryl-β-D-5-phosphoribose
trans,octacis-decaprenylphospho-β-D-ribofuranose 5-phosphate
trans,octa-cis-decaprenylphospho-β-D-ribofuranose 5-phosphate
trans,octacis-decaprenylphospho-β-D-ribofuranose 5-phosphate(3-)
trans,polycis-decaprenylphospho-β-D-ribofuranose 5-phosphate(3-)
  • Miscellaneous

    • Chemical Class:

      Needed for the new reaction: trans,octacis-decaprenyl phosphate + 5-phospho-alpha-D-ribose 1-diphosphate = trans,octacis-decaprenylphospho-beta-D-ribofuranose 5-phosphate + diphosphate ChEBI CHEBI:66937

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

Density:
Boiling Point: 959.4±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 158.4±6.0 kJ/mol
Flash Point: 534.0±37.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 35
#Rule of 5 Violations: 4
ACD/LogP: 18.40
ACD/LogD (pH 5.5): 9.45
ACD/BCF (pH 5.5): 729249.19
ACD/KOC (pH 5.5): 27803.62
ACD/LogD (pH 7.4): 8.74
ACD/BCF (pH 7.4): 139568.02
ACD/KOC (pH 7.4): 5321.22
Polar Surface Area: 200 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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