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CHEBI:211470 - Cytosporone I

ChEBI IDCHEBI:211470
ChEBI NameCytosporone I
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H22O6
Net Charge0
Average Mass334.368
Monoisotopic Mass334.14164
SMILESCCC/C=C/C1OC1C(=O)c1c(O)cc(O)cc1CC(=O)OCC
InChIInChI=1S/C18H22O6/c1-3-5-6-7-14-18(24-14)17(22)16-11(9-15(21)23-4-2)8-12(19)10-13(16)20/h6-8,10,14,18-20H,3-5,9H2,1-2H3/b7-6+
InChIKeyWBKSAYQFOVQAJV-VOTSOKGWSA-N
Species of MetaboliteComponentSourceComments
Neophaeosphaeria quadriseptata (ncbitaxon:125377) - PubMed (18052326)
ChEBI Ontology
Outgoing Relation(s)
Cytosporone I (CHEBI:211470) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
ethyl 2-[3,5-dihydroxy-2-[3-[(E)-pent-1-enyl]oxirane-2-carbonyl]phenyl]acetate
Manual XrefsDatabases
78435969ChemSpider