BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

D-Glucosaminic Acid

Graphical representations:

D-Glucosaminic acid image

Molecular Formula: C6 H13 N O6

Natural Isotopic Abundance Mass: 195.17052

Mono-Isotopic Molecular Masses:

  • C12N14: 195.0742871551
  • C13N14: 201.0944161819
  • C12N15: 196.0713220483
  • C13N15: 202.0914510751

InCHi String:

canonical SMILES: C(C(C(C(C(C(=O)O)N)O)O)O)O

isomeric SMILES: C([C@H]([C@H]([C@@H]([C@H](C(=O)O)N)O)O)O)O

PUBCHEM iupac NAME: PUBCHEM iupac CAS NAME
(2R,3R,4S,5R)-2-amino-3,4,5,6-tetrahydroxyhexanoic acid

PUBCHEM iupac TRADITIONAL NAME: PUBCHEM iupac OPENEYE NAME: PUBCHEM iupac SYSTEMATIC NAME
(2R,3R,4S,5R)-2-amino-3,4,5,6-tetrahydroxy-hexanoic acid

PubChem Substance (SID):   85165229   24895011   11495045
PubChem Compound (CID):   73563
KEGG: Compound ID   n/a
CAS Registry IDs:   6165-14-6
PDB Chemical Component   n/a
Miscellaneous Databases and IDs:   Sigma-Aldrich G0259_SIGMA   ChemBank Spectrum_001231   ChEBI CHEBI:17784   ChemIDplus 006165146   ChemSpider 66245

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.