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CHEBI:205716 - 5-hydroxy-4-oxo-2-(2-oxopropyl)-1,2,3,4-tetrahydronaphthalen-1-yl acetate

ChEBI IDCHEBI:205716
ChEBI Name5-hydroxy-4-oxo-2-(2-oxopropyl)-1,2,3,4-tetrahydronaphthalen-1-yl acetate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H16O5
Net Charge0
Average Mass276.288
Monoisotopic Mass276.09977
SMILESCC(=O)C[C@@H]1CC(=O)c2c(O)cccc2[C@H]1OC(C)=O
InChIInChI=1S/C15H16O5/c1-8(16)6-10-7-13(19)14-11(4-3-5-12(14)18)15(10)20-9(2)17/h3-5,10,15,18H,6-7H2,1-2H3/t10-,15+/m1/s1
InChIKeyTWPGXUHCCFOPSU-BMIGLBTASA-N
Species of MetaboliteComponentSourceComments
Micromonosporaspecies NEAU-gq13 (ncbitaxon:1274800) - PubMed (30585513)
ChEBI Ontology
Outgoing Relation(s)
5-hydroxy-4-oxo-2-(2-oxopropyl)-1,2,3,4-tetrahydronaphthalen-1-yl acetate (CHEBI:205716) is a tetralins (CHEBI:36786)
IUPAC Name 
[(1S,2R)-5-hydroxy-4-oxo-2-(2-oxopropyl)-2,3-dihydro-1H-naphthalen-1-yl] acetate