CHEBI:140202 - aspirin-triggered protectin D1

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name aspirin-triggered protectin D1
ChEBI ID CHEBI:140202
Definition A dihydroxydocosahexaenoic acid that is (4Z,7Z,11E,13E,15Z,19Z)-docosahexaenoic acid in which the two hydroxy substituents are located at positions 10 and 17 (the 10R,17R-stereoisomer).
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ZINC000031168439
Download Molfile XML SDF
Formula C22H32O4
Net Charge 0
Average Mass 360.488
Monoisotopic Mass 360.23006
InChI InChI=1S/C22H32O4/c1-2-3-10-15-20(23)17-12-8-9-13-18-21(24)16-11-6-4-5-7-14-19-22(25)26/h3,5-13,17-18,20-21,23-24H,2,4,14-16,19H2,1H3,(H,25,26)/b7-5-,9-8+,10-3-,11-6-,17-12-,18-13+/t20-,21-/m1/s1
InChIKey CRDZYJSQHCXHEG-HBMALMRFSA-N
SMILES OC(CC/C=C\C/C=C\C[C@H](/C=C/C=C/C=C\[C@@H](C/C=C\CC)O)O)=O
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): 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.
human xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
Application(s): 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.
anti-inflammatory agent
Any compound that has anti-inflammatory effects.
neuroprotective agent
Any compound that can be used for the treatment of neurodegenerative disorders.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing aspirin-triggered protectin D1 (CHEBI:140202) has role anti-inflammatory agent (CHEBI:67079)
aspirin-triggered protectin D1 (CHEBI:140202) has role human xenobiotic metabolite (CHEBI:76967)
aspirin-triggered protectin D1 (CHEBI:140202) has role neuroprotective agent (CHEBI:63726)
aspirin-triggered protectin D1 (CHEBI:140202) has role specialised pro-resolving mediator (CHEBI:140399)
aspirin-triggered protectin D1 (CHEBI:140202) is a dihydroxydocosahexaenoic acid (CHEBI:137348)
aspirin-triggered protectin D1 (CHEBI:140202) is a secondary allylic alcohol (CHEBI:134396)
aspirin-triggered protectin D1 (CHEBI:140202) is conjugate acid of aspirin-triggered protectin D1(1−) (CHEBI:140208)
Incoming aspirin-triggered protectin D1(1−) (CHEBI:140208) is conjugate base of aspirin-triggered protectin D1 (CHEBI:140202)
IUPAC Name
(4Z,7Z,10R,11E,13E,15Z,17R,19Z)-10,17-dihydroxydocosa-4,7,11,13,15,19-hexaenoic acid
Synonyms Sources
(4Z,7Z,10R,11E,13E,15Z,17R,19Z)-10,17-dihydroxydocosahexaenoic acid ChEBI
10(R),17(R)-dihydroxydocosa-4Z,7Z,11E,13E,15Z,19Z-hexaenoic acid ChEBI
aspirin-triggered neuroprotectin D1 ChEBI
AT-(NPD1/PD1) ChEBI
AT-NPD1 ChEBI
AT-PD1 ChEBI
Registry Number Type Source
22110134 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
21867913 PubMed citation Europe PMC
22542947 PubMed citation Europe PMC
22566962 PubMed citation Europe PMC
22690022 PubMed citation Europe PMC
24262603 PubMed citation Europe PMC
24520010 PubMed citation Europe PMC
25139562 PubMed citation Europe PMC
27121596 PubMed citation Europe PMC
Last Modified
09 March 2018