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CHEBI:210614 - (1S,9R,12S,14S)-14-hydroxy-1,12-dimethyl-5,10-dioxatetracyclo[7.6.1.02,7.012,16]hexadeca-2,7-diene-4,11-dione

ChEBI IDCHEBI:210614
ChEBI Name(1S,9R,12S,14S)-14-hydroxy-1,12-dimethyl-5,10-dioxatetracyclo[7.6.1.02,7.012,16]hexadeca-2,7-diene-4,11-dione
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H18O5
Net Charge0
Average Mass290.315
Monoisotopic Mass290.11542
SMILESC[C@@]12C[C@@H](O)C[C@]3(C)C4=CC(=O)OCC4=C[C@@H](OC1=O)C23
InChIInChI=1S/C16H18O5/c1-15-5-9(17)6-16(2)13(15)11(21-14(16)19)3-8-7-20-12(18)4-10(8)15/h3-4,9,11,13,17H,5-7H2,1-2H3/t9-,11+,13?,15+,16-/m0/s1
InChIKeyNQUNKSRIHYKOIX-BWAHQPFKSA-N
Species of MetaboliteComponentSourceComments
Clarireedia homoeocarpa (ncbitaxon:1436886) - PubMed (19928902)
ChEBI Ontology
Outgoing Relation(s)
(1S,9R,12S,14S)-14-hydroxy-1,12-dimethyl-5,10-dioxatetracyclo[7.6.1.02,7.012,16]hexadeca-2,7-diene-4,11-dione (CHEBI:210614) is a organic heterotricyclic compound (CHEBI:26979)
(1S,9R,12S,14S)-14-hydroxy-1,12-dimethyl-5,10-dioxatetracyclo[7.6.1.02,7.012,16]hexadeca-2,7-diene-4,11-dione (CHEBI:210614) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(1S,9R,12S,14S)-14-hydroxy-1,12-dimethyl-5,10-dioxatetracyclo[7.6.1.02,7.012,16]hexadeca-2,7-diene-4,11-dione
Manual XrefsDatabases
24668920ChemSpider