(3R,4R,5R)-3-[(11E)-hexadeca-11,15-dien-9-ynyl]-4-hydroxy-5-methyloxolan-2-one (CHEBI:181088)

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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	(3R,4R,5R)-3-[(11E)-hexadeca-11,15-dien-9-ynyl]-4-hydroxy-5-methyloxolan-2-one

ChEBI ID	CHEBI:181088

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C21H32O3

Net Charge

Average Mass

332.484

Monoisotopic Mass

332.23514

InChI

InChI=1S/C21H32O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-20(22)18(2)24-21(19)23/h3,6-7,18-20,22H,1,4-5,10-17H2,2H3/b7-6+/t18-,19-,20+/m1/s1

InChIKey

XVTXMBZTDMASHY-JCHUFIKGSA-N

SMILES

O1[C@@H]([C@H](O)[C@@H](CCCCCCCCC#C/C=C/CCC=C)C1=O)C

ChEBI Ontology
Outgoing	(3R,4R,5R)-3-[(11E)-hexadeca-11,15-dien-9-ynyl]-4-hydroxy-5-methyloxolan-2-one (CHEBI:181088) is a γ-lactone (CHEBI:37581)

IUPAC Name

(3R,4R,5R)-3-[(11E)-hexadeca-11,15-dien-9-ynyl]-4-hydroxy-5-methyloxolan-2-one