Decanoic acid (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester (CHEBI:215786)

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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	Decanoic acid (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester

ChEBI ID	CHEBI:215786

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H30O4

Net Charge

Average Mass

286.412

Monoisotopic Mass

286.21441

InChI

InChI=1S/C16H30O4/c1-4-5-6-7-8-9-10-11-15(17)18-12-14-13-19-16(2,3)20-14/h14H,4-13H2,1-3H3/t14-/m0/s1

InChIKey

KRBSCYNTGIRIAV-AWEZNQCLSA-N

SMILES

O=C(OC[C@@H]1OC(C)(C)OC1)CCCCCCCCC

Metabolite of Species	Details
Aspergillus terreus (NCBI:txid33178)	See: DOI

ChEBI Ontology
Outgoing	Decanoic acid (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester (CHEBI:215786) is a fatty acid ester (CHEBI:35748)

IUPAC Name

[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl decanoate