CHEBI:215252 - Aspereusin B

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Aspereusin B
ChEBI ID CHEBI:215252
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H20O4
Net Charge 0
Average Mass 252.310
Monoisotopic Mass 252.13616
InChI InChI=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
InChIKey UQYFJJRVYCPYQI-GAJTVXKRSA-N
SMILES O=C1C(=C(C)CC1)CO[C@@H]2OC[C@H]([C@H]2C)C(=O)C
Metabolite of Species Details
Aspergillus (NCBI:txid5052) See: PubMed
ChEBI Ontology
Outgoing 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 Xref Database
78442372 ChemSpider
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