CHEBI:138615 - aspirin-triggered resolvin D3

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ChEBI Name aspirin-triggered resolvin D3
ChEBI ID CHEBI:138615
Definition A member of the class of resolvins that is (5Z,7E,9E,13Z,15E,19Z)-docosahexaenoic acid carrying three hydroxy substituents at positions 4, 11 and 17 (the 4S,11R,17R-stereoisomer)
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Bijay
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C22H32O5
Net Charge 0
Average Mass 376.487
Monoisotopic Mass 376.22497
InChI InChI=1S/C22H32O5/c1-2-3-7-12-19(23)14-10-6-11-15-20(24)13-8-4-5-9-16-21(25)17-18-22(26)27/h3-11,13-14,16,19-21,23-25H,2,12,15,17-18H2,1H3,(H,26,27)/b5-4+,7-3-,11-6-,13-8+,14-10+,16-9-/t19-,20+,21-/m1/s1
InChIKey QBTJOLCUKWLTIC-AXRBAIMGSA-N
SMILES C(=C\[C@@H](C/C=C\C=C\[C@@H](C/C=C\CC)O)O)/C=C/C=C\[C@H](CCC(O)=O)O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) 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): human xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
specialised pro-resolving mediator
A class of cell signaling molecules enzymatically derived from n-3 long chain polyunsaturated fatty acids that have important roles in orchestrating the resolution of tissue inflammation.
(via resolvin )
Application(s): anti-inflammatory agent
Any compound that has anti-inflammatory effects.
specialised pro-resolving mediator
A class of cell signaling molecules enzymatically derived from n-3 long chain polyunsaturated fatty acids that have important roles in orchestrating the resolution of tissue inflammation.
(via resolvin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing aspirin-triggered resolvin D3 (CHEBI:138615) has role anti-inflammatory agent (CHEBI:67079)
aspirin-triggered resolvin D3 (CHEBI:138615) has role human xenobiotic metabolite (CHEBI:76967)
aspirin-triggered resolvin D3 (CHEBI:138615) is a hydroxy polyunsaturated fatty acid (CHEBI:140345)
aspirin-triggered resolvin D3 (CHEBI:138615) is a resolvin (CHEBI:132120)
aspirin-triggered resolvin D3 (CHEBI:138615) is a secondary allylic alcohol (CHEBI:134396)
aspirin-triggered resolvin D3 (CHEBI:138615) is a triol (CHEBI:27136)
IUPAC Name
(4S,5Z,7E,9E,11R,13Z,15E,17R,19Z)-4,11,17-trihydroxydocosa-5,7,9,13,15,19-hexaenoic acid
Synonyms Sources
(4S,5Z,7E,9E,11R,13Z,15E,17R,19Z)-4,11,17-trihydroxydocosahexaenoic acid ChEBI
17-epi-resolvin D3 ChEBI
17-epi-RvD3 ChEBI
aspirin-triggered RvD3 ChEBI
AT-resolvin D3 ChEBI
AT-RvD3 SUBMITTER
Manual Xref Database
CPD66-62 MetaCyc
View more database links
Registry Number Type Source
23608063 Reaxys Registry Number Reaxys
Citations
Last Modified
05 March 2018