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CHEBI:747266 - (7S)‐3‐[(4S)‐4‐hydroxypentyl]‐7‐methyl‐6,8‐dioxo‐7,8‐dihydro‐6H‐isochromen‐7‐yl acetate

ChEBI IDCHEBI:747266
ChEBI Name(7S)‐3‐[(4S)‐4‐hydroxypentyl]‐7‐methyl‐6,8‐dioxo‐7,8‐dihydro‐6H‐isochromen‐7‐yl acetate
Stars
Last Modified29 January 2026
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC17H20O6
Net Charge0
Average Mass320.341
Monoisotopic Mass320.12599
SMILESCC(=O)O[C@@]1(C)C(=O)C=C2C=C(CCC[C@H](C)O)OC=C2C1=O
InChIInChI=1S/C17H20O6/c1-10(18)5-4-6-13-7-12-8-15(20)17(3,23-11(2)19)16(21)14(12)9-22-13/h7-10,18H,4-6H2,1-3H3/t10-,17-/m0/s1
InChIKeyQUBJVRATDUPEAJ-BTDLBPIBSA-N
ChEBI Ontology
Outgoing Relation(s)
(7S)‐3‐[(4S)‐4‐hydroxypentyl]‐7‐methyl‐6,8‐dioxo‐7,8‐dihydro‐6H‐isochromen‐7‐yl acetate (CHEBI:747266) is a acetate ester (CHEBI:47622)
(7S)‐3‐[(4S)‐4‐hydroxypentyl]‐7‐methyl‐6,8‐dioxo‐7,8‐dihydro‐6H‐isochromen‐7‐yl acetate (CHEBI:747266) is a azaphilone (CHEBI:50941)
UniProt Name  Source
(7S)‐3‐[(4S)‐4‐hydroxypentyl]‐7‐methyl‐6,8‐dioxo‐7,8‐dihydro‐6H‐isochromen‐7‐yl acetateUniProt
Citations