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CHEBI:90978 - 20-hydroxylipoxin B4

ChEBI IDCHEBI:90978
ChEBI Name20-hydroxylipoxin B4
Stars
ASCII Name20-hydroxylipoxin B4
DefinitionA member of the class of lipoxins that is lipoxin B4 carrying an additional hydroxy substituent at position 20.
Last Modified24 January 2023
SubmitterSteve
DownloadsMolfile
FormulaC20H32O6
Net Charge0
Average Mass368.470
Monoisotopic Mass368.21989
SMILESO=C(O)CCC[C@H](O)/C=C/C=C\C=C\C=C\[C@@H](O)[C@@H](O)CCCCCO
InChIInChI=1S/C20H32O6/c21-16-9-5-8-14-19(24)18(23)13-7-4-2-1-3-6-11-17(22)12-10-15-20(25)26/h1-4,6-7,11,13,17-19,21-24H,5,8-10,12,14-16H2,(H,25,26)/b3-1-,4-2+,11-6+,13-7+/t17-,18-,19+/m1/s1
InChIKeyZOMUODAIBQTYLE-CFQAQKEBSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (15364545)
Roles Classification
Chemical Role:
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.
Application:
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)
20-hydroxylipoxin B4 (CHEBI:90978) has functional parent lipoxin B4 (CHEBI:6499)
20-hydroxylipoxin B4 (CHEBI:90978) has role human xenobiotic metabolite (CHEBI:76967)
20-hydroxylipoxin B4 (CHEBI:90978) is a hydroxy polyunsaturated fatty acid (CHEBI:140345)
20-hydroxylipoxin B4 (CHEBI:90978) is a lipoxin (CHEBI:6497)
20-hydroxylipoxin B4 (CHEBI:90978) is a ω-hydroxy-long-chain fatty acid (CHEBI:140997)
20-hydroxylipoxin B4 (CHEBI:90978) is conjugate acid of 20-hydroxylipoxin B4(1−) (CHEBI:90711)
Incoming Relation(s)
20-hydroxylipoxin B4(1−) (CHEBI:90711) is conjugate base of 20-hydroxylipoxin B4 (CHEBI:90978)
IUPAC Name 
(5S,6E,8Z,10E,12E,14R,15S)-5,14,15,20-tetrahydroxyicosa-6,8,10,12-tetraenoic acid
Registry NumbersSources
Reaxys:24406266Reaxys
CAS:148942-81-8ChemIDplus
Citations