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CHEBI:181580 - (8aR,12S,12aR)-12-hydroxy-4-methyl-4,5,6,7,8,8a,12,12a-octahydro-1H-3-benzoxecine-2,9-dione

ChEBI IDCHEBI:181580
ChEBI Name(8aR,12S,12aR)-12-hydroxy-4-methyl-4,5,6,7,8,8a,12,12a-octahydro-1H-3-benzoxecine-2,9-dione
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H20O4
Net Charge0
Average Mass252.310
Monoisotopic Mass252.13616
SMILES[H][C@@]12CCCCC(C)OC(=O)C[C@@]1([H])[C@@H](O)C=CC2=O
InChIInChI=1S/C14H20O4/c1-9-4-2-3-5-10-11(8-14(17)18-9)13(16)7-6-12(10)15/h6-7,9-11,13,16H,2-5,8H2,1H3/t9?,10-,11-,13+/m1/s1
InChIKeyWTQWDNIIFGEBSZ-ROAVRGLVSA-N
ChEBI Ontology
Outgoing Relation(s)
(8aR,12S,12aR)-12-hydroxy-4-methyl-4,5,6,7,8,8a,12,12a-octahydro-1H-3-benzoxecine-2,9-dione (CHEBI:181580) is a oxacycle (CHEBI:38104)
IUPAC Name 
(8aR,12S,12aR)-12-hydroxy-4-methyl-4,5,6,7,8,8a,12,12a-octahydro-1H-3-benzoxecine-2,9-dione
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