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CHEBI:182245 - 4,6-dihydroxy-5a-methyl-3-methylidene-2-oxo-4,5,6,7,8,9,9a,9b-octahydro-3aH-benzo[g][1]benzofuran-9-carbaldehyde

ChEBI IDCHEBI:182245
ChEBI Name4,6-dihydroxy-5a-methyl-3-methylidene-2-oxo-4,5,6,7,8,9,9a,9b-octahydro-3aH-benzo[g][1]benzofuran-9-carbaldehyde
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O5
Net Charge0
Average Mass280.320
Monoisotopic Mass280.13107
SMILESC=C1C(=O)OC2C1C(O)CC1(C)C(O)CCC(C=O)C21
InChIInChI=1S/C15H20O5/c1-7-11-9(17)5-15(2)10(18)4-3-8(6-16)12(15)13(11)20-14(7)19/h6,8-13,17-18H,1,3-5H2,2H3
InChIKeyPJDABWGWSDUIAM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4,6-dihydroxy-5a-methyl-3-methylidene-2-oxo-4,5,6,7,8,9,9a,9b-octahydro-3aH-benzo[g][1]benzofuran-9-carbaldehyde (CHEBI:182245) is a sesquiterpene lactone (CHEBI:37667)
IUPAC Name 
4,6-dihydroxy-5a-methyl-3-methylidene-2-oxo-4,5,6,7,8,9,9a,9b-octahydro-3aH-benzo[g][1]benzouran-9-carbaldehyde
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22936721ChemSpider