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Concept information

Preferred term

bromochlorogentisylquinone b  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C7H4BrClO3

inchi

  • InChI=1S/C7H4BrClO3/c8-5-4(11)1-3(2-10)7(12)6(5)9/h1,10H,2H2

inchikey

  • SJHMAJNUGGYXNI-UHFFFAOYSA-N

mass

  • 251.460

monoisotopicmass

  • 249.90323

smiles

  • BrC1=C(Cl)C(=O)C(CO)=CC1=O

subset

  • 2_STAR

synonym EXACT

  • 2-bromo-3-chloro-5-(hydroxymethyl)cyclohexa-2,5-diene-1,4-dione

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:210990

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