Found 1 result

Search term: OKHXOUGRECCASI-SHUUEZRQSA-J (Found by InChIKey (full match))
ChemSpider 2D Image | (2R,3R,4R,5S)-2,3,4,5-Tetrahydroxy-6-oxo-7-(phosphonatooxy)heptyl phosphate | C7H12O13P2

(2R,3R,4R,5S)-2,3,4,5-Tetrahydroxy-6-oxo-7-(phosphonatooxy)heptyl phosphate

  • Molecular FormulaC7H12O13P2
  • Average mass366.112 Da
  • Monoisotopic mass365.977509 Da
  • ChemSpider ID26331126

  • Charge - Charge

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2R,3R,4R,5S)-2,3,4,5-Tetrahydroxy-6-oxo-7-(phosphonatooxy)heptyl phosphate [ACD/IUPAC Name]
(2R,3R,4R,5S)-2,3,4,5-Tetrahydroxy-6-oxo-7-(phosphonatooxy)heptylphosphat [German] [ACD/IUPAC Name]
D-altro-2-Heptulose, 1,7-bis(dihydrogen phosphate), ion(4-) [ACD/Index Name]
Phosphate de (2R,3R,4R,5S)-2,3,4,5-tétrahydroxy-6-oxo-7-(phosphonatooxy)heptyle [French] [ACD/IUPAC Name]
1,7-di-O-phosphonato-D-altro-hept-2-ulose
D-Sedoheptulose 1,7-bisphosphate
D-sedoheptulose-1,7-diphosphate
D-sedoheptulose-1,7-P2
SBP
sedoheptulose 1,7-bisphosphate
More...
  • Miscellaneous

    • Chemical Class:

      A quadruply-charged organophosphate oxoanion arising from deprotonation of the phosphate OH groups of sedoheptulose 1,7-bisphosphate; major species at pH 7.3. ChEBI CHEBI:58335

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

Density:
Boiling Point: 867.3±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 143.2±6.0 kJ/mol
Flash Point: 478.3±37.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 13
#H bond donors: 8
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: -3.24
ACD/LogD (pH 5.5): -9.63
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -11.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 262 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement