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CHEBI:215252 - Aspereusin B

ChEBI IDCHEBI:215252
ChEBI NameAspereusin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC14H20O4
Net Charge0
Average Mass252.310
Monoisotopic Mass252.13616
SMILESCC(=O)[C@@H]1CO[C@@H](OCC2=C(C)CCC2=O)[C@@H]1C
InChIInChI=1S/C14H20O4/c1-8-4-5-13(16)11(8)6-17-14-9(2)12(7-18-14)10(3)15/h9,12,14H,4-7H2,1-3H3/t9-,12-,14-/m1/s1
InChIKeyUQYFJJRVYCPYQI-GAJTVXKRSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (29132077)
ChEBI Ontology
Outgoing Relation(s)
Aspereusin B (CHEBI:215252) is a oxolanes (CHEBI:26912)
IUPAC Name 
2-[[(2S,3R,4S)-4-acetyl-3-methyloxolan-2-yl]oxymethyl]-3-methylcyclopent-2-en-1-one
Manual XrefsDatabases
78442372ChemSpider