CHEBI:200752 - Epoxyroubetaoedione

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Epoxyroubetaoedione
ChEBI ID CHEBI:200752
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H12O7
Net Charge 0
Average Mass 304.254
Monoisotopic Mass 304.05830
InChI InChI=1S/C15H12O7/c1-6-3-10(17)14-13(19)11-8(4-7(20-2)5-9(11)16)12(18)15(14,21-6)22-14/h3-5,13,16,19H,1-2H3/t13-,14-,15+/m1/s1
InChIKey KEIJFRPZODFUBZ-KFWWJZLASA-N
SMILES O=C1C2=C(C(O)=CC(=C2)OC)[C@@H](O)[C@@]34[C@@]1(OC(=CC3=O)C)O4
Metabolite of Species Details
Roussoella (NCBI:txid63193) See: PubMed
ChEBI Ontology
Outgoing Epoxyroubetaoedione (CHEBI:200752) is a organic heterotricyclic compound (CHEBI:26979)
Epoxyroubetaoedione (CHEBI:200752) is a organooxygen compound (CHEBI:36963)
IUPAC Name
(1S,2R,10R)-2,4-dihydroxy-6-methoxy-12-methyl-11,15-dioxatetracyclo[8.4.1.01,10.03,8]pentadeca-3(8),4,6,12-tetraene-9,14-dione