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CHEBI:202632 - Aspochalasin K

ChEBI IDCHEBI:202632
ChEBI NameAspochalasin K
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H39NO5
Net Charge0
Average Mass433.589
Monoisotopic Mass433.28282
SMILESCOC1C(O)CC/C(C)=C/[C@H]2C=C(C)[C@@H](C)[C@H]3[C@H](CC(C)C)NC(=O)[C@]32C(=O)CC1O
InChIInChI=1S/C25H39NO5/c1-13(2)9-18-22-16(5)15(4)11-17-10-14(3)7-8-19(27)23(31-6)20(28)12-21(29)25(17,22)24(30)26-18/h10-11,13,16-20,22-23,27-28H,7-9,12H2,1-6H3,(H,26,30)/b14-10+/t16-,17+,18+,19?,20?,22+,23?,25-/m1/s1
InChIKeyVDFBOYQHOXIVOC-ZVMWUMDVSA-N
Species of MetaboliteComponentSourceComments
Aspergillus flavipes (ncbitaxon:41900) - PubMed (15043404)
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)
Aspochalasin K (CHEBI:202632) has role fungal metabolite (CHEBI:76946)
Aspochalasin K (CHEBI:202632) is a cytochalasin (CHEBI:23528)
IUPAC Name 
(1S,9E,11S,14S,15R,16S)-4,6-dihydroxy-5-methoxy-9,13,14-trimethyl-16-(2-methylpropyl)-17-azatricyclo[9.7.0.01,15]octadeca-9,12-diene-2,18-dione
Manual XrefsDatabases
10186297ChemSpider