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CHEBI:67617 - 4'-epichaetoviridin F

ChEBI IDCHEBI:67617
ChEBI Name4'-epichaetoviridin F
Stars
DefinitionAn azaphilone that is 6H-furo[2,3-h]isochromene-6,8(6aH)-dione substituted by a chloro group at position 5, a methyl group at position 6a, a 2-methylbutanoyl group at position 9 and a 3-methylpent-1-en-1-yl group at position 3. It has been isolated from Chaetomium globosum.
Last Modified15 October 2013
DownloadsMolfile
FormulaC23H25ClO5
Net Charge0
Average Mass416.901
Monoisotopic Mass416.13905
SMILESCC[C@H](C)/C=C/C1=CC2=C(Cl)C(=O)[C@@]3(C)OC(=O)C(C(=O)[C@H](C)CC)=C3C2=CO1
InChIInChI=1S/C23H25ClO5/c1-6-12(3)8-9-14-10-15-16(11-28-14)18-17(20(25)13(4)7-2)22(27)29-23(18,5)21(26)19(15)24/h8-13H,6-7H2,1-5H3/b9-8+/t12-,13+,23-/m0/s1
InChIKeySPBQVEOEFQCPDM-YMWLQJPLSA-N
Species of MetaboliteComponentSourceComments
Chaetomium globosum (ncbitaxon:38033)
mycelium (BTO:0001436) PubMed (21548578) Endophytic fungus in leaves of Viguiera robusta, EtOAc extract of culture broth and mycelium
- PubMed (21548578)
Roles Classification
Biological Role:
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
ChEBI Ontology
Outgoing Relation(s)
4'-epichaetoviridin F (CHEBI:67617) is a azaphilone (CHEBI:50941)
4'-epichaetoviridin F (CHEBI:67617) is a enone (CHEBI:51689)
4'-epichaetoviridin F (CHEBI:67617) is a organic heterotricyclic compound (CHEBI:26979)
4'-epichaetoviridin F (CHEBI:67617) is a organochlorine compound (CHEBI:36683)
4'-epichaetoviridin F (CHEBI:67617) is a γ-lactone (CHEBI:37581)
IUPAC Name 
(6aS)-5-chloro-6a-methyl-9-[(2R)-2-methylbutanoyl]-3-[(1E,3S)-3-methylpent-1-en-1-yl]-6H-furo[2,3-h]isochromene-6,8(6aH)-dione
Registry NumbersSources
Reaxys:21577523Reaxys
Citations