Palmitic acid(d3) (CHEBI:168544)

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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	Palmitic acid(d3)

ChEBI ID	CHEBI:168544

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H29D3O2

Net Charge

Average Mass

259.448

Monoisotopic Mass

259.25906

InChI

InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)/i1D3

InChIKey

IPCSVZSSVZVIGE-FIBGUPNXSA-N

SMILES

OC(=O)CCCCCCCCCCCCCCC([2H])([2H])[2H]

Metabolite of Species	Details
Malus domestica (NCBI:txid3750)	Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	Palmitic acid(d3) (CHEBI:168544) is a deuterated fatty acid (CHEBI:75427) Palmitic acid(d3) (CHEBI:168544) is a long-chain fatty acid (CHEBI:15904)

IUPAC Name

16,16,16-trideuteriohexadecanoic acid

Last Modified

25 January 2023