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CHEBI:175053 - (6beta,7alpha,12beta,13beta)-7-Hydroxy-11,16-dioxo-8,14-apianadien-22,6-olide

ChEBI IDCHEBI:175053
ChEBI Name(6beta,7alpha,12beta,13beta)-7-Hydroxy-11,16-dioxo-8,14-apianadien-22,6-olide
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H28O5
Net Charge0
Average Mass384.472
Monoisotopic Mass384.19367
SMILESCC1=CC(=O)C2(C(C)C)C(=O)C3=C(C(O)C4OC(=O)C35CCCC(C)(C)C45)C12
InChIInChI=1S/C23H28O5/c1-10(2)23-12(24)9-11(3)14(23)13-15(19(23)26)22-8-6-7-21(4,5)18(22)17(16(13)25)28-20(22)27/h9-10,14,16-18,25H,6-8H2,1-5H3
InChIKeyIEPYKUBVROCHOQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
(6beta,7alpha,12beta,13beta)-7-Hydroxy-11,16-dioxo-8,14-apianadien-22,6-olide (CHEBI:175053) is a terpene lactone (CHEBI:37668)
IUPAC Name 
10-hydroxy-7,13,13-trimethyl-4-propan-2-yl-18-oxapentacyclo[9.5.2.01,12.02,9.04,8]octadeca-2(9),6-diene-3,5,17-trione
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35013356ChemSpider
HMDB0031380HMDB