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CHEBI:214567 - Gymnoconjugatin A

ChEBI IDCHEBI:214567
ChEBI NameGymnoconjugatin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H20O4
Net Charge0
Average Mass324.376
Monoisotopic Mass324.13616
SMILESCOc1cc(/C(C)=C/C=C/C=C/C=C/c2ccco2)oc(=O)c1C
InChIInChI=1S/C20H20O4/c1-15(18-14-19(22-3)16(2)20(21)24-18)10-7-5-4-6-8-11-17-12-9-13-23-17/h4-14H,1-3H3/b6-4+,7-5+,11-8+,15-10+
InChIKeyXVSFUQXNRYVANI-OAJXTGRCSA-N
Species of MetaboliteComponentSourceComments
Gymnoascus reessii (ncbitaxon:69890) - PubMed (16468746)
ChEBI Ontology
Outgoing Relation(s)
Gymnoconjugatin A (CHEBI:214567) is a pyranone (CHEBI:37963)
IUPAC Name 
6-[(2E,4E,6E,8E)-9-(uran-2-yl)nona-2,4,6,8-tetraen-2-yl]-4-methoxy-3-methylpyran-2-one
Manual XrefsDatabases
9891531ChemSpider