BMRB

Biological Magnetic Resonance Data Bank


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

Dichloroisoproterenol Hydrochloride

Dichloroisoproterenol Hydrochloride synonyms

Wikipedia:

Graphical representations:

Dichloroisoproterenol hydrochloride image

View large 3D structure

Molecular Formula: C11H15Cl2NO

Natural Isotopic Abundance Mass: 248.1489

Mono-Isotopic Molecular Masses:

  • C12N14: 247.053069465
  • C13N14: 258.089972683
  • C12N15: 248.050104358
  • C13N15: 259.087007576

InChI String: InChI=1S/C11H15Cl2NO/c1-7(2)14-6-11(15)8-3-4-9(12)10(13)5-8/h3-5,7,11,14-15H,6H2,1-2H3/t11-/m0/s1

SMILES:

PubChem Substance (SID):   n/a
PubChem Compound (CID):   443400
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