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CHEBI:202398 - (3aS)-7-hydroxy-3a,5,5,8-tetramethyl-3,3a,4,5-tetrahydro-1H-cyclopenta[de]isochromen-1-one

ChEBI IDCHEBI:202398
ChEBI Name(3aS)-7-hydroxy-3a,5,5,8-tetramethyl-3,3a,4,5-tetrahydro-1H-cyclopenta[de]isochromen-1-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H18O3
Net Charge0
Average Mass246.306
Monoisotopic Mass246.12559
SMILESCc1c(O)cc2c3c1C(=O)OC[C@@]3(C)CC2(C)C
InChIInChI=1S/C15H18O3/c1-8-10(16)5-9-12-11(8)13(17)18-7-15(12,4)6-14(9,2)3/h5,16H,6-7H2,1-4H3/t15-/m1/s1
InChIKeyOGKCRIOQDYPIOZ-OAHLLOKOSA-N
Species of MetaboliteComponentSourceComments
Hypoxylon rickii (ncbitaxon:110545) - PubMed (26071840)
ChEBI Ontology
Outgoing Relation(s)
(3aS)-7-hydroxy-3a,5,5,8-tetramethyl-3,3a,4,5-tetrahydro-1H-cyclopenta[de]isochromen-1-one (CHEBI:202398) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
(4S)-10-hydroxy-2,2,4,9-tetramethyl-6-oxatricyclo[6.3.1.04,12]dodeca-1(11),8(12),9-trien-7-one
Manual XrefsDatabases
78443385ChemSpider