Aspergone B (CHEBI:227555)

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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	Aspergone B

ChEBI ID	CHEBI:227555

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C11H14O3

Net Charge

Average Mass

194.230

Monoisotopic Mass

194.09429

InChI

InChI=1S/C11H14O3/c1-3-4-5-10-7-9(6-8(2)12)11(13)14-10/h3-5,7-8,12H,6H2,1-2H3/b4-3+,10-5-/t8-/m0/s1

InChIKey

YXGLHZDPYZEASC-DFTJNCBESA-N

SMILES

O=C1O\C(=C/C=C/C)\C=C1C[C@@H](O)C

Metabolite of Species	Details
Aspergillusspecies OUCMDZ-1583 (NCBI:txid1548012)	See: DOI

ChEBI Ontology
Outgoing	Aspergone B (CHEBI:227555) is a butenolide (CHEBI:50523)

IUPAC Name

(5Z)-5-[(E)-but-2-enylidene]-3-[(2S)-2-hydroxypropyl]uran-2-one