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CHEBI:143749 - (5R)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)tetradecan-3-one

ChEBI IDCHEBI:143749
ChEBI Name(5R)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)tetradecan-3-one
Stars
Submittermwilliams
DownloadsMolfile
FormulaC21H34O4
Net Charge0
Average Mass350.499
Monoisotopic Mass350.24571
SMILESCCCCCCCCC[C@@H](O)CC(=O)CCc1ccc(O)c(OC)c1
InChIInChI=1S/C21H34O4/c1-3-4-5-6-7-8-9-10-18(22)16-19(23)13-11-17-12-14-20(24)21(15-17)25-2/h12,14-15,18,22,24H,3-11,13,16H2,1-2H3/t18-/m1/s1
InChIKeyAIULWNKTYPZYAN-GOSISDBHSA-N
Species of MetaboliteComponentSourceComments
Bathymodiolus (ncbitaxon:12965) gill filament (BTO:0002150) MetaboLights (MTBLS746)
ChEBI Ontology
Outgoing Relation(s)
(5R)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)tetradecan-3-one (CHEBI:143749) is a monomethoxybenzene (CHEBI:25235)
(5R)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)tetradecan-3-one (CHEBI:143749) is a phenols (CHEBI:33853)
(5R)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)tetradecan-3-one (CHEBI:143749) is a β-hydroxy ketone (CHEBI:55380)