HARIBOSS

Harnessing RIBOnucleic acid - Small molecules Structures

Compound G6P

Identifiers

  • Canonical SMILES: 
    O[C@H]1O[C@H](CO[P](O)(O)=O)[C@@H](O)[C@H](O)[C@H]1O
  • IUPAC name: 
    6-O-phosphono-alpha-D-glucopyranose
  • InChi: 
    InChI=1S/C6H13O9P/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6+/m1/s1
  • InChiKey: 
    NBSCHQHZLSJFNQ-DVKNGEFBSA-N

Chemistry rules

Lipinski's RO5 Veber Pfizer's 3/75

External links

439284 DB02007

RNA-SM complexes

PDB code Deposition date Reference publication
2ho7 July 13, 2006 Klein Daniel J., Ferré-D'Amaré Adrian R.. . Structural Basis of glmS Ribozyme Activation by Glucosamine-6-Phosphate Science
3l3c Dec. 16, 2009 Cochrane Jesse C., Lipchock Sarah V., Smith Kathryn D., Strobel Scott A.. . Structural and Chemical Basis for Glucosamine 6-Phosphate Binding and Activation of the glmS Ribozyme Biochemistry
3l3c Dec. 16, 2009 Cochrane Jesse C., Lipchock Sarah V., Smith Kathryn D., Strobel Scott A.. . Structural and Chemical Basis for Glucosamine 6-Phosphate Binding and Activation of the glmS Ribozyme Biochemistry
3l3c Dec. 16, 2009 Cochrane Jesse C., Lipchock Sarah V., Smith Kathryn D., Strobel Scott A.. . Structural and Chemical Basis for Glucosamine 6-Phosphate Binding and Activation of the glmS Ribozyme Biochemistry
3l3c Dec. 16, 2009 Cochrane Jesse C., Lipchock Sarah V., Smith Kathryn D., Strobel Scott A.. . Structural and Chemical Basis for Glucosamine 6-Phosphate Binding and Activation of the glmS Ribozyme Biochemistry

Physicochemical filters

Descriptor Lipinski's RO5 Veber Pfizer's 3/75
Compliance
MW 260.03 g/mol
HBA 7
HBD 6
HBA + HBD
AlogP -3.10
TPSA 156.91
RB 3

Radar chart