CHEBI:136809 - 2-hydroxyethyl hexadecanoate

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ChEBI Name 2-hydroxyethyl hexadecanoate
ChEBI ID CHEBI:136809
Definition A hexadecanoate ester obtained by the formal condensation of carboxy group of hexadecaoic acid with one of the hydroxy groups of ethylene glycol
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C18H36O3
Net Charge 0
Average Mass 300.477
Monoisotopic Mass 300.26645
InChI InChI=1S/C18H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)21-17-16-19/h19H,2-17H2,1H3
InChIKey BXCRLBBIZJSWNS-UHFFFAOYSA-N
SMILES C(CCCCCCCCCC)CCCCC(OCCO)=O
Metabolite of Species Details
Brassica napus (NCBI:txid3708) See: PubMed
Brassica napus (NCBI:txid3708) See: MetaboLights Study
Roles Classification
Biological Role(s): Brassica napus metabolite
Any plant metabolite that is produced by rapeseed (Brassica napus).
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ChEBI Ontology
Outgoing 2-hydroxyethyl hexadecanoate (CHEBI:136809) has functional parent ethylene glycol (CHEBI:30742)
2-hydroxyethyl hexadecanoate (CHEBI:136809) has role Brassica napus metabolite (CHEBI:140165)
2-hydroxyethyl hexadecanoate (CHEBI:136809) is a hexadecanoate ester (CHEBI:25835)
2-hydroxyethyl hexadecanoate (CHEBI:136809) is a primary alcohol (CHEBI:15734)
IUPAC Name
2-hydroxyethyl hexadecanoate
Synonyms Sources
1-monopalmitoylethylene glycol MetaCyc
2-hydroxyethyl palmitate ChEBI
ethylene glycol monohexadecanoate ChEBI
ethylene glycol monopalmitate ChemIDplus
Glycol palmitate ChemIDplus
Hexadecanoic acid, 2-hydroxyethyl ester ChemIDplus
Palmitic acid, 2-hydroxyethyl ester ChemIDplus
Palmitoylglycol ChemIDplus
Manual Xrefs Databases
19028 ChemSpider
CPD0-1811 MetaCyc
View more database links
Registry Numbers Types Sources
1789719 Beilstein Registry Number ChemIDplus
1789719 Reaxys Registry Number Reaxys
4219-49-2 CAS Registry Number ChemIDplus
4219-49-2 CAS Registry Number NIST Chemistry WebBook
Last Modified
16 April 2018