ethyl (5Z,8Z,11Z,14Z,17Z)-icosapentaenoate (CHEBI:84883)

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CHEBI:84883 - ethyl (5Z,8Z,11Z,14Z,17Z)-icosapentaenoate

ChEBI ID	CHEBI:84883
ChEBI Name	ethyl (5Z,8Z,11Z,14Z,17Z)-icosapentaenoate
Stars
ASCII Name	ethyl (5Z,8Z,11Z,14Z,17Z)-icosapentaenoate
Definition	A long-chain fatty acid ethyl ester resulting from the formal condensation of the carboxy group of (5Z,8Z,11Z,14Z,17Z)-icosapentaenoic acid with the hydroxy group of ethanol.
Secondary ChEBI ID	CHEBI:80366
Last Modified	14 January 2020
Submitter	Steve
Downloads	Molfile

Formula	C22H34O2
Net Charge	0
Average Mass	330.512
Monoisotopic Mass	330.25588
SMILES	CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OCC
InChI	InChI=1S/C22H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24-4-2/h5-6,8-9,11-12,14-15,17-18H,3-4,7,10,13,16,19-21H2,1-2H3/b6-5-,9-8-,12-11-,15-14-,18-17-
InChIKey	SSQPWTVBQMWLSZ-AAQCHOMXSA-N

Wikipedia

Roles Classification

Biological Role:

marine metabolite Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.

Applications:

anticholesteremic drug A substance used to lower plasma cholesterol levels.

prodrug A compound that, on administration, must undergo chemical conversion by metabolic processes before becoming the pharmacologically active drug for which it is a prodrug.

antidepressant Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.

antipsychotic agent Antipsychotic drugs are agents that control agitated psychotic behaviour, alleviate acute psychotic states, reduce psychotic symptoms, and exert a quieting effect.

ChEBI Ontology

Outgoing Relation(s)
	ethyl (5Z,8Z,11Z,14Z,17Z)-icosapentaenoate (CHEBI:84883) has functional parent all-cis-5,8,11,14,17-icosapentaenoic acid (CHEBI:28364)
	ethyl (5Z,8Z,11Z,14Z,17Z)-icosapentaenoate (CHEBI:84883) has role anticholesteremic drug (CHEBI:35821)
	ethyl (5Z,8Z,11Z,14Z,17Z)-icosapentaenoate (CHEBI:84883) has role antidepressant (CHEBI:35469)
	ethyl (5Z,8Z,11Z,14Z,17Z)-icosapentaenoate (CHEBI:84883) has role antipsychotic agent (CHEBI:35476)
	ethyl (5Z,8Z,11Z,14Z,17Z)-icosapentaenoate (CHEBI:84883) has role marine metabolite (CHEBI:76507)
	ethyl (5Z,8Z,11Z,14Z,17Z)-icosapentaenoate (CHEBI:84883) has role prodrug (CHEBI:50266)
	ethyl (5Z,8Z,11Z,14Z,17Z)-icosapentaenoate (CHEBI:84883) is a long-chain fatty acid ethyl ester (CHEBI:13209)
	ethyl (5Z,8Z,11Z,14Z,17Z)-icosapentaenoate (CHEBI:84883) is a polyunsaturated fatty ester (CHEBI:145039)

IUPAC Name
ethyl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate

INN	Source
icosapent	ChemIDplus

Synonyms	Source
(5Z,8Z,11Z,14Z,17Z)-Eicosapentaenoic acid ethyl ester	KEGG COMPOUND
(all-Z)-5,8,11,14,17-Eicosapentaenoic acid ethyl ester	ChemIDplus
AMR 101	ChemIDplus
AMR101	ChemIDplus
cis-Eicosapentaenoic acid ethyl ester	ChemIDplus
E-EPA	ChEBI

Brand Names	Source
Epadel	ChemIDplus
Vascepa	ChemIDplus

Manual Xrefs	Databases
1413	DrugCentral
C16184	KEGG COMPOUND
D01892	KEGG DRUG
Ethyl_eicosapentaenoic_acid	Wikipedia
HMDB0039530	HMDB

Registry Numbers	Sources
Reaxys:4811237	Reaxys
CAS:86227-47-6	ChemIDplus
CAS:86227-47-6	KEGG COMPOUND

Citations