ChemSpider 2D Image | (4R)-4-[(S)-(2-Amino-4-oxo-1,4,7,8-tetrahydro-6-pteridinyl)(hydroxy)methyl]-1,3,2-dioxaphospholan-2-olate 2-oxide | C9H11N5O6P

(4R)-4-[(S)-(2-Amino-4-oxo-1,4,7,8-tetrahydro-6-pteridinyl)(hydroxy)methyl]-1,3,2-dioxaphospholan-2-olate 2-oxide

  • Molecular FormulaC9H11N5O6P
  • Average mass316.188 Da
  • Monoisotopic mass316.045258 Da
  • ChemSpider ID26331402

  • Charge - Charge

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4R) 2-Oxyde de 4-[(S)-(2-amino-4-oxo-1,4,7,8-tétrahydro-6-ptéridinyl)(hydroxy)méthyl]-1,3,2-dioxaphospholan-2-olate [French] [ACD/IUPAC Name]
(4R)-4-[(S)-(2-Amino-4-oxo-1,4,7,8-tetrahydro-6-pteridinyl)(hydroxy)methyl]-1,3,2-dioxaphospholan-2-olat-2-oxid [German] [ACD/IUPAC Name]
(4R)-4-[(S)-(2-Amino-4-oxo-1,4,7,8-tetrahydro-6-pteridinyl)(hydroxy)methyl]-1,3,2-dioxaphospholan-2-olate 2-oxide [ACD/IUPAC Name]
4(3H)-Pteridinone, 2-amino-7,8-dihydro-6-[(S)-hydroxy[(4R)-2-hydroxy-2-oxido-1,3,2-dioxaphospholan-4-yl]methyl]-, ion(1-) [ACD/Index Name]
(4R)-4-[(S)-(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)(hydroxy)methyl]-1,3,2-dioxaphospholan-2-olate 2-oxide
(4R)-4-[(S)-(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)(hydroxy)methyl]-2-oxo-1,3,2λ(5)-dioxaphospholan-2-olate
7,8-dihydro-D-neopterin 2',3'-cyclic phosphate
7,8-dihydro-D-neopterin 2',3'-cyclic phosphate(1-)
7,8-dihydroneopterin 2',3'-cyclic phosphate
  • Miscellaneous

    • Chemical Class:

      An organophosphate oxoanion that is the conjugate base of 7,8-dihydro-D-neopterin 2',3'-cyclic phosphate, arising from deprotonation of the phosphate OH. ChEBI CHEBI:58854

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 2
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 181 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement