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CHEBI:199635 - Rel-(2R,3R,4R)-2,3,4-trihydroxypentyl 2,4-dihydroxy-6-methylbenzoate

ChEBI IDCHEBI:199635
ChEBI NameRel-(2R,3R,4R)-2,3,4-trihydroxypentyl 2,4-dihydroxy-6-methylbenzoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H18O7
Net Charge0
Average Mass286.280
Monoisotopic Mass286.10525
SMILESCc1cc(O)cc(O)c1C(=O)OC[C@H](O)[C@@H](O)[C@H](C)O
InChIInChI=1S/C13H18O7/c1-6-3-8(15)4-9(16)11(6)13(19)20-5-10(17)12(18)7(2)14/h3-4,7,10,12,14-18H,5H2,1-2H3/t7-,10-,12-/m0/s1
InChIKeyYCFDXHRFIXXGRO-JWYUURKGSA-N
Species of MetaboliteComponentSourceComments
Chaetomium (ncbitaxon:5149) - DOI (10.1002/hlca.201300329)
ChEBI Ontology
Outgoing Relation(s)
Rel-(2R,3R,4R)-2,3,4-trihydroxypentyl 2,4-dihydroxy-6-methylbenzoate (CHEBI:199635) is a 4-hydroxybenzoate ester (CHEBI:79323)
IUPAC Name 
[(2S,3S,4S)-2,3,4-trihydroxypentyl] 2,4-dihydroxy-6-methylbenzoate
Manual XrefsDatabases
78440781ChemSpider