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CHEBI:208104 - Curdepsidone E

Default Structure
ChEBI IDCHEBI:208104
ChEBI NameCurdepsidone E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H26O10
Net Charge0
Average Mass462.451
Monoisotopic Mass462.15260
SMILESCCO[C@@H](C[C@@H](O)C(=O)OC)c1c(O)c(OC)c(C)c2c1Oc1c(C)cc(O)cc1OC2=O
InChIInChI=1S/C23H26O10/c1-6-31-14(9-13(25)22(27)30-5)17-18(26)20(29-4)11(3)16-21(17)33-19-10(2)7-12(24)8-15(19)32-23(16)28/h7-8,13-14,24-26H,6,9H2,1-5H3/t13-,14+/m1/s1
InChIKeyANDMQMLAINBTIK-KGLIPLIRSA-N
Species of MetaboliteComponentSourceComments
Curvulariaspecies IFB-Z10 (ncbitaxon:1526222) - PubMed (31060304)
ChEBI Ontology
Outgoing Relation(s)
Curdepsidone E (CHEBI:208104) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
methyl (2R,4S)-4-(3,9-dihydroxy-8-methoxy-1,7-dimethyl-6-oxobenzo[b][1,4]benzodioxepin-10-yl)-4-ethoxy-2-hydroxybutanoate
Manual XrefsDatabases
74122696ChemSpider