aspirin-triggered resolvin D2 (CHEBI:138614)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:138614 - aspirin-triggered resolvin D2

Take structure to advanced search

ChEBI ID	CHEBI:138614
ChEBI Name	aspirin-triggered resolvin D2
Stars
Definition	A member of the class of resolvins that is (4Z,8E,10Z,12E,14E,19Z)-docosahexaenoic acid carrying three hydroxy substituents at positions 7, 16 and 17 (the 7S,16R,17R-stereoisomer).
Last Modified	23 June 2025
Submitter	Bijay
Downloads	Molfile

Formula	C22H32O5
Net Charge	0
Average Mass	376.493
Monoisotopic Mass	376.22497
SMILES	CC/C=C\C[C@@H](O)[C@H](O)/C=C/C=C/C=C\C=C\[C@@H](O)C/C=C\CCC(=O)O
InChI	InChI=1S/C22H32O5/c1-2-3-9-16-20(24)21(25)17-12-7-5-4-6-10-14-19(23)15-11-8-13-18-22(26)27/h3-12,14,17,19-21,23-25H,2,13,15-16,18H2,1H3,(H,26,27)/b6-4-,7-5+,9-3-,11-8-,14-10+,17-12+/t19-,20-,21-/m1/s1
InChIKey	IKFAUGXNBOBQDM-FYSWCGKBSA-N

Species of Metabolite	Component	Source	Comments
Homo sapiens (ncbitaxon:9606)	-	PubMed (21071715)

Roles Classification

Chemical Roles:	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:	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.
Applications:	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.

ChEBI Ontology

Outgoing Relation(s)
	aspirin-triggered resolvin D2 (CHEBI:138614) has role anti-inflammatory agent (CHEBI:67079)
	aspirin-triggered resolvin D2 (CHEBI:138614) has role human xenobiotic metabolite (CHEBI:76967)
	aspirin-triggered resolvin D2 (CHEBI:138614) is a hydroxy polyunsaturated fatty acid (CHEBI:140345)
	aspirin-triggered resolvin D2 (CHEBI:138614) is a resolvin (CHEBI:132120)
	aspirin-triggered resolvin D2 (CHEBI:138614) is a secondary allylic alcohol (CHEBI:134396)
	aspirin-triggered resolvin D2 (CHEBI:138614) is a triol (CHEBI:27136)

IUPAC Name
(4Z,7S,8E,10Z,12E,14E,16R,17R,19Z)-7,16,17-trihydroxydocosa-4,8,10,12,14,19-hexaenoic acid

Synonyms	Source
AT-RvD2	SUBMITTER
aspirin-triggered RvD2	ChEBI
aspirin-triggered resolvin D2	ChEBI
(4Z,7S,8E,10Z,12E,14E,16R,17R,19Z)-7,16,17-trihydroxydocosahexaenoic acid	ChEBI
17-epi-RvD2	ChEBI
17-epi-resolvin D2	ChEBI

Manual Xrefs	Databases
CPD66-61	MetaCyc
LMFA04030006	LIPID MAPS

Citations