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CHEBI:182437 - (7,9b-Dihydroxy-6,6,9a-trimethyl-3-oxo-1,5,5a,7,8,9-hexahydrobenzo[e][2]benzofuran-5-yl) hexanoate

ChEBI IDCHEBI:182437
ChEBI Name(7,9b-Dihydroxy-6,6,9a-trimethyl-3-oxo-1,5,5a,7,8,9-hexahydrobenzo[e][2]benzofuran-5-yl) hexanoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H32O6
Net Charge0
Average Mass380.481
Monoisotopic Mass380.21989
SMILESCCCCCC(=O)OC1C=C2C(=O)OCC2(O)C2(C)CCC(O)C(C)(C)C12
InChIInChI=1S/C21H32O6/c1-5-6-7-8-16(23)27-14-11-13-18(24)26-12-21(13,25)20(4)10-9-15(22)19(2,3)17(14)20/h11,14-15,17,22,25H,5-10,12H2,1-4H3
InChIKeyCCTUVGJRXQPMOJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
(7,9b-Dihydroxy-6,6,9a-trimethyl-3-oxo-1,5,5a,7,8,9-hexahydrobenzo[e][2]benzofuran-5-yl) hexanoate (CHEBI:182437) is a naphthofuran (CHEBI:39270)
IUPAC Name 
(7,9b-dihydroxy-6,6,9a-trimethyl-3-oxo-1,5,5a,7,8,9-hexahydrobenzo[e][2]benzouran-5-yl) hexanoate
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