CHEBI:132485 - N-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-L-glutamic acid

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ChEBI Name N-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-L-glutamic acid
ChEBI ID CHEBI:132485
ChEBI ASCII Name N-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-L-glutamic acid
Definition An N-(long-chain-fatty-acyl)-L-glutamic acid in which the acyl group is specified as (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C27H39NO5
Net Charge 0
Average Mass 457.603
Monoisotopic Mass 457.28282
InChI InChI=1S/C27H39NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(29)28-24(27(32)33)22-23-26(30)31/h3-4,6-7,9-10,12-13,15-16,18-19,24H,2,5,8,11,14,17,20-23H2,1H3,(H,28,29)(H,30,31)(H,32,33)/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18-/t24-/m0/s1
InChIKey NMAOXADCTJAFFT-PJEZTNATSA-N
SMILES C(C(N[C@H](C(O)=O)CCC(=O)O)=O)C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC
Metabolite of Species Details
Calanus helgolandicus (NCBI:txid114068) See: MetaboLights Study
Calanus helgolandicus (NCBI:txid114068) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): marine metabolite
Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
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ChEBI Ontology
Outgoing N-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-L-glutamic acid (CHEBI:132485) has functional parent all-cis-docosa-4,7,10,13,16,19-hexaenoic acid (CHEBI:28125)
N-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-L-glutamic acid (CHEBI:132485) has role marine metabolite (CHEBI:76507)
N-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-L-glutamic acid (CHEBI:132485) is a N-(long-chain-fatty-acyl)-L-glutamic acid (CHEBI:21745)
Synonyms Sources
N-(4Z,7Z,10Z,12E,16Z,19Z-docosahexaenoyl)-glutamic acid LIPID MAPS
N-(docosahexaenoyl)-L-glutamic acid ChEBI
N-(docosahexaenoyl)glutamic acid ChEBI
N-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]glutamic acid ChEBI
N-docosahexaenoyl glutamic acid LIPID MAPS
N-docosahexaenoylglutamic acid ChEBI
Manual Xref Database
LMFA08020089 LIPID MAPS
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Registry Number Type Source
20745818 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
26364855 PubMed citation Europe PMC
Last Modified
13 January 2017