CHEBI:206106 - Aspersclerolide 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 Aspersclerolide B
ChEBI ID CHEBI:206106
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C8H12O5
Net Charge 0
Average Mass 188.179
Monoisotopic Mass 188.06847
InChI InChI=1S/C8H12O5/c1-5-3-7(10)13-8(5,11)6(4-9)12-2/h3,6,9,11H,4H2,1-2H3
InChIKey XQAIXLUSZOVBMW-UHFFFAOYSA-N
SMILES O=C1OC(O)(C(OC)CO)C(=C1)C
Metabolite of Species Details
Aspergillus sclerotiorum (NCBI:txid138282) See: PubMed
ChEBI Ontology
Outgoing Aspersclerolide B (CHEBI:206106) is a butenolide (CHEBI:50523)
IUPAC Name
5-hydroxy-5-(2-hydroxy-1-methoxyethyl)-4-methyluran-2-one
Manual Xref Database
77001589 ChemSpider
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