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CHEBI:206927 - 4-bromo-6-hydroxymellein

ChEBI IDCHEBI:206927
ChEBI Name4-bromo-6-hydroxymellein
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SubmitterMetaboLights
DownloadsMolfile
FormulaC10H9BrO4
Net Charge0
Average Mass273.082
Monoisotopic Mass271.96842
SMILESC[C@@H]1OC(=O)c2c(O)cc(O)cc2[C@@H]1Br
InChIInChI=1S/C10H9BrO4/c1-4-9(11)6-2-5(12)3-7(13)8(6)10(14)15-4/h2-4,9,12-13H,1H3/t4-,9+/m0/s1
InChIKeyGIFQQBPEWSZJEA-AJAUBTJJSA-N
Species of MetaboliteComponentSourceComments
Lachnum (ncbitaxon:47817) - PubMed (7730162)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
4-bromo-6-hydroxymellein (CHEBI:206927) is a hydroxybenzoic acid (CHEBI:24676)
IUPAC Name 
(3S,4S)-4-bromo-6,8-dihydroxy-3-methyl-3,4-dihydroisochromen-1-one
Manual XrefsDatabases
78436206ChemSpider