CHEBI:74018 - leukotriene E3

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name leukotriene E3
ChEBI ID CHEBI:74018
ChEBI ASCII Name leukotriene E3
Definition A leukotriene that is leukotriene E4 in which the non-conjugated double bond has been reduced to a single bond.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C23H39NO5S
Net Charge 0
Average Mass 441.62400
Monoisotopic Mass 441.25489
InChI InChI=1S/C23H39NO5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-21(30-18-19(24)23(28)29)20(25)15-14-17-22(26)27/h9-13,16,19-21,25H,2-8,14-15,17-18,24H2,1H3,(H,26,27)(H,28,29)/b10-9-,12-11+,16-13+/t19-,20-,21+/m0/s1
InChIKey KRTWHKZMWCZCIK-VRZYSOTLSA-N
SMILES CCCCCCCC\C=C/C=C/C=C/[C@@H](SC[C@H](N)C(O)=O)[C@@H](O)CCCC(O)=O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing leukotriene E3 (CHEBI:74018) is a L-cysteine thioether (CHEBI:27532)
leukotriene E3 (CHEBI:74018) is a amino dicarboxylic acid (CHEBI:36164)
leukotriene E3 (CHEBI:74018) is a leukotriene (CHEBI:25029)
leukotriene E3 (CHEBI:74018) is a non-proteinogenic L-α-amino acid (CHEBI:83822)
leukotriene E3 (CHEBI:74018) is a secondary alcohol (CHEBI:35681)
Incoming 14-carboxy-15,16,17,18,19,20-hexanor-leukotriene E3 (CHEBI:74019) has functional parent leukotriene E3 (CHEBI:74018)
IUPAC Names
(5S,6R,7E,9E,11Z)-6-(L-cystein-S-yl)-5-hydroxyicosa-7,9,11-trienoic acid
(5S,6R,7E,9E,11Z)-6-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-5-hydroxyicosa-7,9,11-trienoic acid
Synonyms Sources
14,15-dihydro-leukotriene E4 ChEBI
14,15-dihydro-LTE4 ChEBI
LTE3 ChEBI
Manual Xref Database
HMDB0002355 HMDB
View more database links
Registry Number Type Source
5999071 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
6116705 PubMed citation Europe PMC
6273168 PubMed citation Europe PMC
6895224 PubMed citation Europe PMC
7053383 PubMed citation Europe PMC
Last Modified
20 November 2014