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CHEBI:198976 - (S)-5,7-dichloro-6-hydroxy-2-methyl-2,3-dihydrobenzofuran-4-carboxylic acid

ChEBI IDCHEBI:198976
ChEBI Name(S)-5,7-dichloro-6-hydroxy-2-methyl-2,3-dihydrobenzofuran-4-carboxylic acid
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SubmitterMetaboLights
DownloadsMolfile
FormulaC10H8Cl2O4
Net Charge0
Average Mass263.076
Monoisotopic Mass261.97996
SMILESC[C@H]1Cc2c(c(Cl)c(O)c(Cl)c2C(=O)O)O1
InChIInChI=1S/C10H8Cl2O4/c1-3-2-4-5(10(14)15)6(11)8(13)7(12)9(4)16-3/h3,13H,2H2,1H3,(H,14,15)/t3-/m0/s1
InChIKeyXVIJGBVFPGZOOI-VKHMYHEASA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(S)-5,7-dichloro-6-hydroxy-2-methyl-2,3-dihydrobenzofuran-4-carboxylic acid (CHEBI:198976) is a chlorobenzoic acid (CHEBI:23134)
IUPAC Name 
(2S)-5,7-dichloro-6-hydroxy-2-methyl-2,3-dihydro-1-benzouran-4-carboxylic acid
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