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CHEBI:90696 - thromboxane B2(1−)

ChEBI IDCHEBI:90696
ChEBI Namethromboxane B2(1−)
Stars
ASCII Namethromboxane B2(1-)
DefinitionA thromboxane anion that is the conjugate base of thromboxane B2, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified9 November 2016
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC20H33O6
Net Charge-1
Average Mass369.478
Monoisotopic Mass369.22826
SMILESCCCCC[C@H](O)/C=C/[C@H]1OC(O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)[O-]
InChIInChI=1S/C20H34O6/c1-2-3-6-9-15(21)12-13-18-16(17(22)14-20(25)26-18)10-7-4-5-8-11-19(23)24/h4,7,12-13,15-18,20-22,25H,2-3,5-6,8-11,14H2,1H3,(H,23,24)/p-1/b7-4-,13-12+/t15-,16-,17-,18+,20?/m0/s1
InChIKeyXNRNNGPBEPRNAR-JQBLCGNGSA-M
ChEBI Ontology
Outgoing Relation(s)
thromboxane B2(1−) (CHEBI:90696) is a thromboxane anion (CHEBI:62945)
thromboxane B2(1−) (CHEBI:90696) is conjugate base of thromboxane B2 (CHEBI:28728)
Incoming Relation(s)
thromboxane B2 (CHEBI:28728) is conjugate acid of thromboxane B2(1−) (CHEBI:90696)
IUPAC Name 
(5Z,13E,15S)-9α,11,15-trihydroxythromboxa-5,13-dien-1-oate
UniProt Name  Source
thromboxane B2UniProt
Citations