Trans-9-hydroxy-3-methyl-8-oxo-dodec-trans-6-en-4-olide (CHEBI:189166)

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CHEBI:189166 - Trans-9-hydroxy-3-methyl-8-oxo-dodec-trans-6-en-4-olide

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ChEBI ID	CHEBI:189166
ChEBI Name	Trans-9-hydroxy-3-methyl-8-oxo-dodec-trans-6-en-4-olide
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C13H20O4
Net Charge	0
Average Mass	240.299
Monoisotopic Mass	240.13616
SMILES	CCCC(O)C(=O)/C=C/C[C@@H]1OC(=O)C[C@H]1C
InChI	InChI=1S/C13H20O4/c1-3-5-10(14)11(15)6-4-7-12-9(2)8-13(16)17-12/h4,6,9-10,12,14H,3,5,7-8H2,1-2H3/b6-4+/t9-,10?,12+/m1/s1
InChIKey	AQBDNVSAYLLLQP-ZWLNJPIUSA-N

Species of Metabolite	Component	Source	Comments
Arabidopsis thaliana (ncbitaxon:3702)	leaf (BTO:0000713)	MetaboLights (MTBLS3997)

ChEBI Ontology

Outgoing Relation(s)
	Trans-9-hydroxy-3-methyl-8-oxo-dodec-trans-6-en-4-olide (CHEBI:189166) is a aliphatic alcohol (CHEBI:2571)

IUPAC Name
(4R,5S)-5-[(E)-5-hydroxy-4-oxooct-2-enyl]-4-methyloxolan-2-one

Manual Xrefs	Databases
9239666	ChemSpider