Biological Magnetic Resonance Data Bank

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


Graphical representations:

L-Serine image

View large 3D structure

Molecular Formula: C3 H7 N O3

Natural Isotopic Abundance Mass: 105.0925800000

Mono-Isotopic Molecular Masses:

  • C12N14: 105.042593096
  • C13N14: 108.05265761
  • C12N15: 106.039627989
  • C13N15: 109.0496925028

InChI String: InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1

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

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

(2S)-2-amino-3-hydroxy-propanoic acid

PubChem Substance (SID):   85164896   148777   3365
PubChem Compound (CID):   5951
KEGG: Compound ID   C00065
CAS Registry IDs:   56-45-1   6898-95-9
PDB Chemical Component   SER   SER_LFOH   SER_LFZW
Miscellaneous Databases and IDs:   CHEBI 17115   EINECS 200-274-3   HSDB 680   Beilstein Handbook Reference 4-04-00-03118   NSC 118365

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

Atom numbering calculated using ALATIS. Citation: Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73,