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CHEBI:747269 - (3S,6'S,7R)‐5,6',7‐trimethyl‐6,8‐dioxo‐1,4,6,7,8,8a‐hexahydrospiro[2‐benzopyran‐3,2'‐oxan]‐7‐yl acetate

ChEBI IDCHEBI:747269
ChEBI Name(3S,6'S,7R)‐5,6',7‐trimethyl‐6,8‐dioxo‐1,4,6,7,8,8a‐hexahydrospiro[2‐benzopyran‐3,2'‐oxan]‐7‐yl acetate
Stars
Last Modified29 January 2026
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC18H24O6
Net Charge0
Average Mass336.384
Monoisotopic Mass336.15729
SMILESCC(=O)O[C@@]1(C)C(=O)C(C)=C2C[C@@]3(CCC[C@H](C)O3)OCC2C1=O
InChIInChI=1S/C18H24O6/c1-10-6-5-7-18(23-10)8-13-11(2)15(20)17(4,24-12(3)19)16(21)14(13)9-22-18/h10,14H,5-9H2,1-4H3/t10-,14?,17-,18-/m0/s1
InChIKeyDJOJUSSRCXCTDC-ZIDWXYGASA-N
ChEBI Ontology
Outgoing Relation(s)
(3S,6'S,7R)‐5,6',7‐trimethyl‐6,8‐dioxo‐1,4,6,7,8,8a‐hexahydrospiro[2‐benzopyran‐3,2'‐oxan]‐7‐yl acetate (CHEBI:747269) is a acetate ester (CHEBI:47622)
(3S,6'S,7R)‐5,6',7‐trimethyl‐6,8‐dioxo‐1,4,6,7,8,8a‐hexahydrospiro[2‐benzopyran‐3,2'‐oxan]‐7‐yl acetate (CHEBI:747269) is a spiro compound (CHEBI:33599)
UniProt Name  Source
(3S,6'S,7R)‐5,6',7‐trimethyl‐6,8‐dioxo‐1,4,6,7,8,8a‐hexahydrospiro[2‐benzopyran‐3,2'‐oxan]‐7‐yl acetateUniProt
Citations