Biological Magnetic Resonance Data Bank

A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
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2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-one synonyms



Graphical representations:


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Molecular Formula: C15H10O7

Natural Isotopic Abundance Mass: 302.2357

Mono-Isotopic Molecular Masses:

  • C12N14: 302.04265266
  • C13N14: 317.09297523
  • C12N15: 302.04265266
  • C13N15: 317.09297523

InChI string: InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H

MMCD: cq_18823
PDB Compound ID: QUE
PubChem Compound (CID): 14709285

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,