BMRB

Biological Magnetic Resonance Data Bank


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

G-b-G-AcO

G-b-G-AcO synonyms

G-b-G

Wikipedia:

Graphical representations:

G-b-G-AcO

View large 3D structure

Molecular Formula: C24H28O9

Natural Isotopic Abundance Mass: 460.47372

Mono-Isotopic Molecular Masses:

  • C12N14: 460.1733324977
  • C13N14: 484.2538486049
  • C12N15: 460.1733324977
  • C13N15: 484.2538486049

InChI string: InChI=1S/C24H28O9/c1-14-7-9-20(21(11-14)28-5)33-23(13-30-15(2)25)24(32-17(4)27)18-8-10-19(31-16(3)26)22(12-18)29-6/h7-12,23-24H,13H2,1-6H3/t23-,24-/m0/s1

USDA_NMR_database: 227

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)