4-hexadecanoyl-3-hydroxy-2-(hydroxymethyl)-2H-furan-5-one (CHEBI:203519)

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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	4-hexadecanoyl-3-hydroxy-2-(hydroxymethyl)-2H-furan-5-one

ChEBI ID	CHEBI:203519

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C21H36O5

Net Charge

Average Mass

368.514

Monoisotopic Mass

368.25627

InChI

InChI=1S/C21H36O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17(23)19-20(24)18(16-22)26-21(19)25/h18,22,24H,2-16H2,1H3/t18-/m0/s1

InChIKey

KZTSLHQKWLYYAC-SFHVURJKSA-N

SMILES

O=C1O[C@@H](CO)C(=C1C(=O)CCCCCCCCCCCCCCC)O

Metabolite of Species	Details
Actinomyces (NCBI:txid1654)	See: PubMed

ChEBI Ontology
Outgoing	4-hexadecanoyl-3-hydroxy-2-(hydroxymethyl)-2H-furan-5-one (CHEBI:203519) is a butenolide (CHEBI:50523)

IUPAC Name

4-hexadecanoyl-3-hydroxy-2-(hydroxymethyl)-2H-uran-5-one