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CHEBI:213766 - 2,6-dihydroxy-4-[(2R)-2-hydroxyheptyl]benzoic acid

ChEBI IDCHEBI:213766
ChEBI Name2,6-dihydroxy-4-[(2R)-2-hydroxyheptyl]benzoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H20O5
Net Charge0
Average Mass268.309
Monoisotopic Mass268.13107
SMILESCCCCC[C@@H](O)Cc1cc(O)c(C(=O)O)c(O)c1
InChIInChI=1S/C14H20O5/c1-2-3-4-5-10(15)6-9-7-11(16)13(14(18)19)12(17)8-9/h7-8,10,15-17H,2-6H2,1H3,(H,18,19)/t10-/m1/s1
InChIKeyFYQVGLHZARJMDM-SNVBAGLBSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (32114035)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2,6-dihydroxy-4-[(2R)-2-hydroxyheptyl]benzoic acid (CHEBI:213766) has functional parent salicylic acid (CHEBI:16914)
2,6-dihydroxy-4-[(2R)-2-hydroxyheptyl]benzoic acid (CHEBI:213766) is a hydroxybenzoic acid (CHEBI:24676)
IUPAC Name 
2,6-dihydroxy-4-[(2R)-2-hydroxyheptyl]benzoic acid
Manual XrefsDatabases
9055361ChemSpider