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CHEBI:138583 - 19-hydroxythromboxane A2

ChEBI IDCHEBI:138583
ChEBI Name19-hydroxythromboxane A2
Stars
ASCII Name19-hydroxythromboxane A2
DefinitionA thromboxane A that is thromboxane A2 carrying an additional hydroxy substituent at position 19.
Last Modified2 October 2017
SubmitterSteve
DownloadsMolfile
FormulaC20H32O6
Net Charge0
Average Mass368.470
Monoisotopic Mass368.21989
SMILESCC(O)CCC[C@H](O)/C=C/[C@H]1O[C@H]2C[C@H](O2)[C@@H]1C/C=C\CCCC(=O)O
InChIInChI=1S/C20H32O6/c1-14(21)7-6-8-15(22)11-12-17-16(18-13-20(25-17)26-18)9-4-2-3-5-10-19(23)24/h2,4,11-12,14-18,20-22H,3,5-10,13H2,1H3,(H,23,24)/b4-2-,12-11+/t14?,15-,16+,17+,18-,20+/m0/s1
InChIKeyWOQBOHYWWJRXPR-SVALGRSTSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (15789615)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
ChEBI Ontology
Outgoing Relation(s)
19-hydroxythromboxane A2 (CHEBI:138583) has functional parent thromboxane A2 (CHEBI:15627)
19-hydroxythromboxane A2 (CHEBI:138583) has role human xenobiotic metabolite (CHEBI:76967)
19-hydroxythromboxane A2 (CHEBI:138583) is a diol (CHEBI:23824)
19-hydroxythromboxane A2 (CHEBI:138583) is a epoxy monocarboxylic acid (CHEBI:23931)
19-hydroxythromboxane A2 (CHEBI:138583) is a secondary allylic alcohol (CHEBI:134396)
19-hydroxythromboxane A2 (CHEBI:138583) is a thromboxanes A (CHEBI:36088)
19-hydroxythromboxane A2 (CHEBI:138583) is conjugate acid of 19-hydroxythromboxane A2(1−) (CHEBI:137988)
Incoming Relation(s)
19-hydroxythromboxane A2(1−) (CHEBI:137988) is conjugate base of 19-hydroxythromboxane A2 (CHEBI:138583)
IUPAC Name 
(5Z,13E,15S)-9α,11α-epoxy-15,19-dihydroxythromboxa-5,13-dien-1-oic acid
Synonym  Source
19-hydroxy-TXA2ChEBI
Citations