BMRB

Biological Magnetic Resonance Data Bank


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

Berberine Chloride

Berberine Chloride bmse001193 - Data

Berberine Chloride synonyms

Wikipedia:

Graphical representations:

Berberine

View large 3D structure

Molecular Formula: C20H18ClNO4

Natural Isotopic Abundance Mass: 371.81422

Mono-Isotopic Molecular Masses:

  • C12N14: 371.092435741
  • C13N14: 391.159532501001
  • C12N15: 372.089470634001
  • C13N15: 392.156567394001

InChI string: InChI=1S/C20H18NO4.ClH/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2;/h3-4,7-10H,5-6,11H2,1-2H3;1H/q+1;/p-1

MMCD: cq_09129
PubChem Compound (CID): 155773

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (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)