CHEBI:199459 - Deflectin 1b

ChEBI IDCHEBI:199459
ChEBI NameDeflectin 1b
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H28O5
Net Charge0
Average Mass384.472
Monoisotopic Mass384.19367
SMILESCCCCCCCCCC(=O)C1=C2C3=COC(C)=CC3=CC(=O)[C@]2(C)OC1=O
InChIInChI=1S/C23H28O5/c1-4-5-6-7-8-9-10-11-18(24)20-21-17-14-27-15(2)12-16(17)13-19(25)23(21,3)28-22(20)26/h12-14H,4-11H2,1-3H3/t23-/m0/s1
InChIKeyIJPKWZQBHXLBPJ-QHCPKHFHSA-N
Species of MetaboliteComponentSourceComments
Aspergillus deflectus (ncbitaxon:41745) - PubMed (7319924)
ChEBI Ontology
Outgoing Relation(s)
Deflectin 1b (CHEBI:199459) is a polyketide (CHEBI:26188)
IUPAC Name 
(6aR)-9-decanoyl-3,6a-dimethyluro[2,3-h]isochromene-6,8-dione
Manual XrefsDatabases
25052503ChemSpider