EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:57445 - thromboxane A2(1−)

ChEBI IDCHEBI:57445
ChEBI Namethromboxane A2(1−)
Stars
ASCII Namethromboxane A2(1-)
DefinitionConjugate base of thromboxane A2 arising from deprotonation of the carboxylic acid function.
Last Modified24 April 2015
DownloadsMolfile
FormulaC20H31O5
Net Charge-1
Average Mass351.463
Monoisotopic Mass351.21770
SMILESCCCCC[C@H](O)/C=C/[C@H]1O[C@H]2C[C@H](O2)[C@@H]1C/C=C\CCCC(=O)[O-]
InChIInChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18-14-20(24-17)25-18)10-7-4-5-8-11-19(22)23/h4,7,12-13,15-18,20-21H,2-3,5-6,8-11,14H2,1H3,(H,22,23)/p-1/b7-4-,13-12+/t15-,16+,17+,18-,20+/m0/s1
InChIKeyDSNBHJFQCNUKMA-SCKDECHMSA-M
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
thromboxane A2(1−) (CHEBI:57445) has role human metabolite (CHEBI:77746)
thromboxane A2(1−) (CHEBI:57445) is a monocarboxylic acid anion (CHEBI:35757)
thromboxane A2(1−) (CHEBI:57445) is a thromboxane anion (CHEBI:62945)
thromboxane A2(1−) (CHEBI:57445) is conjugate base of thromboxane A2 (CHEBI:15627)
Incoming Relation(s)
18-hydroxythromboxane A2(1−) (CHEBI:137989) has functional parent thromboxane A2(1−) (CHEBI:57445)
19-hydroxythromboxane A2(1−) (CHEBI:137988) has functional parent thromboxane A2(1−) (CHEBI:57445)
thromboxane A2 (CHEBI:15627) is conjugate acid of thromboxane A2(1−) (CHEBI:57445)
IUPAC Name 
(5Z,13E,15S)-9α,11α-epoxy-15-hydroxythromboxa-5,13-dien-1-oate
Synonym  Source
thromboxane A2 anionChEBI
UniProt Name  Source
thromboxane A2UniProt