BMRB

Biological Magnetic Resonance Data Bank


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

Arecoline Hydrobromide

Arecoline Hydrobromide bmse001225 - Data

Arecoline Hydrobromide synonyms

arecoline hydrobromide

Wikipedia:

Graphical representations:

Arecoline hydrobromide image

View large 3D structure

Molecular Formula: C8H13NO2

Natural Isotopic Abundance Mass: 155.19432

Mono-Isotopic Molecular Masses:

  • C12N14: 155.094628661
  • C13N14: 163.121467365
  • C12N15: 156.091663554
  • C13N15: 164.118502258

InChI String: InChI=1S/C8H13NO2/c1-9-5-3-4-7(6-9)8(10)11-2/h4H,3,5-6H2,1-2H3

SMILES:

PubChem Substance (SID):   n/a
PubChem Compound (CID):   2230
KEGG: Compound ID   n/a
CAS Registry IDs:   n/a
PDB Chemical Component   n/a
Miscellaneous Databases and IDs:   n/a

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, https://www.nature.com/articles/sdata201773