Found 8 results

Search term: MF = 'C_{48}H_{79}N_{3}O_{15}P_{2}'
ChemSpider 2D Image | 5'-O-{[({(2R)-2,3-Bis[(9Z,12Z)-9,12-octadecadienoyloxy]propoxy}phosphinato)oxy]phosphinato}cytidine | C48H79N3O15P2

5'-O-{[({(2R)-2,3-Bis[(9Z,12Z)-9,12-octadecadienoyloxy]propoxy}phosphinato)oxy]phosphinato}cytidine

  • Molecular FormulaC48H79N3O15P2
  • Average mass1000.101 Da
  • Monoisotopic mass999.499756 Da
  • ChemSpider ID34999659

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

    defined stereocentres - 5 of 5 defined stereocentres

More details:

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

5'-O-{[({(2R)-2,3-Bis[(9Z,12Z)-9,12-octadecadienoyloxy]propoxy}phosphinato)oxy]phosphinato}cytidin [German] [ACD/IUPAC Name]
5'-O-{[({(2R)-2,3-Bis[(9Z,12Z)-9,12-octadecadienoyloxy]propoxy}phosphinato)oxy]phosphinato}cytidine [ACD/IUPAC Name]
5'-O-{[({(2R)-2,3-Bis[(9Z,12Z)-9,12-octadecadienoyloxy]propoxy}phosphinato)oxy]phosphinato}cytidine [French] [ACD/IUPAC Name]
Cytidine, 5'-O-[[[[(2R)-2,3-bis[[(9Z,12Z)-1-oxo-9,12-octadecadien-1-yl]oxy]propoxy]hydroxyphosphinyl]oxy]hydroxyphosphinyl]-, ion(2-) [ACD/Index Name]
1,2-di-(9Z,12Z-octadecadienoyl)-sn-glycero-3-cytidine-5'-diphosphate
CDP-1,2-dilinoleoyl-sn-glycerol(2-)
  • Miscellaneous

    • Chemical Class:

      A CDP-diacylglycerol(2-) obtained by deprotonation of the diphosphate OH groups of CDP-1,2-dilinoleoyl-sn-glycerol; major species at pH 7.3. ChEBI CHEBI:85355

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

Density:
Boiling Point: 979.8±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 161.9±6.0 kJ/mol
Flash Point: 546.4±37.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 18
#H bond donors: 6
#Freely Rotating Bonds: 42
#Rule of 5 Violations: 4
ACD/LogP: 11.65
ACD/LogD (pH 5.5): 4.09
ACD/BCF (pH 5.5): 67.64
ACD/KOC (pH 5.5): 40.62
ACD/LogD (pH 7.4): 3.97
ACD/BCF (pH 7.4): 50.75
ACD/KOC (pH 7.4): 30.47
Polar Surface Area: 289 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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