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CHEBI:211676 - Aspochalasin L

ChEBI IDCHEBI:211676
ChEBI NameAspochalasin L
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H39NO6
Net Charge0
Average Mass449.588
Monoisotopic Mass449.27774
SMILESCOC1CC(=O)[C@@]23C(=O)N[C@@H](CC(C)C)[C@@H]2C(C)=C(C)[C@H](O)[C@@H]3/C=C(\C)CCC(O)C1O
InChIInChI=1S/C25H39NO6/c1-12(2)9-17-21-14(4)15(5)22(29)16-10-13(3)7-8-18(27)23(30)19(32-6)11-20(28)25(16,21)24(31)26-17/h10,12,16-19,21-23,27,29-30H,7-9,11H2,1-6H3,(H,26,31)/b13-10+/t16-,17-,18?,19?,21-,22-,23?,25+/m0/s1
InChIKeySEJALNVFDONJGO-GXVMMTHKSA-N
Species of MetaboliteComponentSourceComments
Aspergillus flavipes (ncbitaxon:41900) - PubMed (15981416)
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 L (CHEBI:211676) has role fungal metabolite (CHEBI:76946)
Aspochalasin L (CHEBI:211676) is a cytochalasin (CHEBI:23528)
IUPAC Name 
(1R,9E,11R,12R,15R,16S)-5,6,12-trihydroxy-4-methoxy-9,13,14-trimethyl-16-(2-methylpropyl)-17-azatricyclo[9.7.0.01,15]octadeca-9,13-diene-2,18-dione
Manual XrefsDatabases
9571651ChemSpider