BMRB

Biological Magnetic Resonance Data Bank


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

O-phospho-DL-threonine

Graphical representations:

O-phospho-DL-threonine image

Molecular Formula: C4 H10 N O6 P

Natural Isotopic Abundance Mass: 199.099061

Mono-Isotopic Molecular Masses:

  • C12N14: 199.0245735688
  • C13N14: 203.03799292
  • C12N15: 200.021608462
  • C13N15: 204.0350278132

InCHi String:

canonical and isomeric SMILES: CC(C(C(=O)O)N)OP(=O)(O)O

PUBCHEM iupac NAME: PUBCHEM iupac CAS NAME
2-amino-3-phosphonooxybutanoic acid

PUBCHEM iupac TRADITIONAL NAME
2-amino-3-phosphonooxy-butyric acid

PUBCHEM iupac OPENEYE NAME
2-amino-3-phosphonooxy-butanoic acid

PUBCHEM iupac SYSTEMATIC NAME
2-azanyl-3-phosphonooxy-butanoic acid

PubChem Substance (SID):   111677773   6449738   24898142
PubChem Compound (CID):   1016
KEGG: Compound ID   n/a
CAS Registry IDs:   27530-80-9
PDB Chemical Component   D11   TPO
Miscellaneous Databases and IDs:   Sigma-Aldrich P1003_SIGMA   ChemDB 6420121   DTP/NCI 89296   MMCD cq_18970   MDL MFCD00135662

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.