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CHEBI:175880 - 6b-Angeloyl-3b,8b,9b-trihydroxy-7(11)-eremophilen-12,8-olide

ChEBI IDCHEBI:175880
ChEBI Name6b-Angeloyl-3b,8b,9b-trihydroxy-7(11)-eremophilen-12,8-olide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H28O7
Net Charge0
Average Mass380.437
Monoisotopic Mass380.18350
SMILESC/C=C(\C)C(=O)OC1C2=C(C)C(=O)OC2(O)C(O)C2CCC(O)C(C)C12C
InChIInChI=1S/C20H28O7/c1-6-9(2)17(23)26-16-14-10(3)18(24)27-20(14,25)15(22)12-7-8-13(21)11(4)19(12,16)5/h6,11-13,15-16,21-22,25H,7-8H2,1-5H3/b9-6+
InChIKeyMSDFIROCDXOIAM-RMKNXTFCSA-N
ChEBI Ontology
Outgoing Relation(s)
6b-Angeloyl-3b,8b,9b-trihydroxy-7(11)-eremophilen-12,8-olide (CHEBI:175880) is a terpene lactone (CHEBI:37668)
IUPAC Name 
(6,9,9a-trihydroxy-3,4a,5-trimethyl-2-oxo-5,6,7,8,8a,9-hexahydro-4H-benzo[][1]benzouran-4-yl) (E)-2-methylbut-2-enoate
Manual XrefsDatabases
HMDB0041228HMDB
35015133ChemSpider