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:

Ethanolamine image

Molecular Formula: C2 H7 N O

Natural Isotopic Abundance Mass: 61.0830800000

Mono-Isotopic Molecular Masses:

  • C12N14: 61.052763852
  • C13N14: 63.0594735276
  • C12N15: 62.0497987452
  • C13N15: 64.0565084208

InCHi String:

canonical SMILES: C(CO)N

IUPAC: IUPAC traditional: IUPAC openeye: IUPAC cas: IUPAC systematic

PubChem Substance (SID):   85165081   151996   3489
PubChem Compound (CID):   700
KEGG: Compound ID   C00189
CAS Registry IDs:   9007-33-4   141-43-5
PDB Chemical Component   n/a
Miscellaneous Databases and IDs:   ChemIDplus 000141435   EINECS 205-483-3   Caswell No. 426   CCRIS 6260   EPA Pesticide Chemical Code 011601   HSDB 531

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.