CHEBI:138718 - all-trans-retinyl tetradecanoate

ChEBI IDCHEBI:138718
ChEBI Nameall-trans-retinyl tetradecanoate
Stars
ASCII Nameall-trans-retinyl tetradecanoate
DefinitionAn all-trans-retinyl ester obtained by formal condensation of the carboxy group of tetradecanoic acid with the hydroxy group of all-trans-retinol.
Last Modified28 July 2021
Submitternhn
DownloadsMolfile
FormulaC34H56O2
Net Charge0
Average Mass496.820
Monoisotopic Mass496.42803
SMILESCCCCCCCCCCCCCC(=O)OC/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)CCCC1(C)C
InChIInChI=1S/C34H56O2/c1-7-8-9-10-11-12-13-14-15-16-17-23-33(35)36-28-26-30(3)21-18-20-29(2)24-25-32-31(4)22-19-27-34(32,5)6/h18,20-21,24-26H,7-17,19,22-23,27-28H2,1-6H3/b21-18+,25-24+,29-20+,30-26+
InChIKeyWIYYXLSPNGTKOH-OGBLRLSYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (20552420)
Roles Classification
Biological Roles:
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
fat-soluble vitamin (role)  Any vitamin that dissolves in fats and are stored in body tissues. Unlike the water-soluble vitamins, they are stored in the body for long periods of time and generally pose a greater risk for toxicity when consumed in excess.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
all-trans-retinyl tetradecanoate (CHEBI:138718) has role human xenobiotic metabolite (CHEBI:76967)
all-trans-retinyl tetradecanoate (CHEBI:138718) is a all-trans-retinyl ester (CHEBI:63410)
all-trans-retinyl tetradecanoate (CHEBI:138718) is a tetradecanoate ester (CHEBI:87691)
IUPAC Name 
(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl tetradecanoate
Synonyms  Source
all-trans-retinyl myristateSUBMITTER
retinyl tetradecanoateChEBI
retinyl myristateChEBI
O15-tetradecanoylretinolChEBI
vitamin A myristateChEBI
vitamin A tetradecanoateChEBI
UniProt Name  Source
all-trans-retinyl tetradecanoateUniProt
Manual XrefsDatabases
8227106ChemSpider
Registry NumbersSources
Reaxys:30597702Reaxys
CAS:1181-93-7ChemIDplus
Citations