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CHEBI:68730 - chaetomugilin D

ChEBI IDCHEBI:68730
ChEBI Namechaetomugilin D
Stars
DefinitionAn azaphilone isolated from Chaetomium globosum and has been shown to exhibit inhibitory activity against the brine shrimp (Artemia salina) and Mucor miehei.
Last Modified16 October 2013
DownloadsMolfile
FormulaC23H27ClO6
Net Charge0
Average Mass434.916
Monoisotopic Mass434.14962
SMILES[H][C@]12C3=COC(/C=C/[C@@H](C)CC)=CC3=C(Cl)C(=O)[C@@]1(C)O[C@]1(O)[C@H](C)[C@@H](C)OC(=O)[C@]21[H]
InChIInChI=1S/C23H27ClO6/c1-6-11(2)7-8-14-9-15-16(10-28-14)17-18-21(26)29-13(4)12(3)23(18,27)30-22(17,5)20(25)19(15)24/h7-13,17-18,27H,6H2,1-5H3/b8-7+/t11-,12+,13+,17+,18-,22-,23+/m0/s1
InChIKeyVFAOIGZBHFMFIU-XSKLMDGHSA-N
Species of MetaboliteComponentSourceComments
Chaetomium globosum (ncbitaxon:38033) - PubMed (19246197)
Roles Classification
Biological Roles:
Chaetomium metabolite  Any fungal metabolite produced during a metabolic reaction in the mould, Chaetomium.
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)
chaetomugilin D (CHEBI:68730) has role Chaetomium metabolite (CHEBI:76960)
chaetomugilin D (CHEBI:68730) is a azaphilone (CHEBI:50941)
chaetomugilin D (CHEBI:68730) is a enone (CHEBI:51689)
chaetomugilin D (CHEBI:68730) is a organic heterotetracyclic compound (CHEBI:38163)
chaetomugilin D (CHEBI:68730) is a organochlorine compound (CHEBI:36683)
chaetomugilin D (CHEBI:68730) is a tertiary alcohol (CHEBI:26878)
chaetomugilin D (CHEBI:68730) is a δ-lactone (CHEBI:18946)
IUPAC Name 
(6aS,7aR,8R,9R,11aR,11bS)-5-chloro-7a-hydroxy-6a,8,9-trimethyl-3-[(1E,3S)-3-methylpent-1-en-1-yl]-6a,7a,8,9,11a,11b-hexahydro-6H,11H-pyrano[3',4':4,5]furo[2,3-h]isochromene-6,11-dione
Manual XrefsDatabases
24705878ChemSpider
Registry NumbersSources
Reaxys:19646845Reaxys
Citations