CHEBI:28667 - 11-dehydro-thromboxane B2

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ChEBI Name 11-dehydro-thromboxane B2
ChEBI ID CHEBI:28667
ChEBI ASCII Name 11-dehydro-thromboxane B2
Definition A thromboxane obtained by formal oxidation of the hemiacetal hydroxy function of thromboxane B2.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:710, CHEBI:19122
Supplier Information
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Formula C20H32O6
Net Charge 0
Average Mass 368.46448
Monoisotopic Mass 368.220
InChI InChI=1S/C20H32O6/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/h4,7,12-13,15-18,21-22H,2-3,5-6,8-11,14H2,1H3,(H,23,24)/b7-4-,13-12+/t15-,16-,17-,18+/m0/s1
InChIKey KJYIVXDPWBUJBQ-UHHGALCXSA-N
SMILES CCCCC[C@H](O)\C=C\[C@H]1OC(=O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O
Metabolite of Species Details
Homo sapiens (NCBI:9606) See: DOI
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 11-dehydro-thromboxane B2 (CHEBI:28667) has functional parent thromboxane B2 (CHEBI:28728)
11-dehydro-thromboxane B2 (CHEBI:28667) has role human metabolite (CHEBI:77746)
11-dehydro-thromboxane B2 (CHEBI:28667) is a thromboxane (CHEBI:26995)
11-dehydro-thromboxane B2 (CHEBI:28667) is conjugate acid of 11-dehydro-thromboxane B2(1−) (CHEBI:136539)
Incoming 11-dehydro-thromboxane B2(1−) (CHEBI:136539) is conjugate base of 11-dehydro-thromboxane B2 (CHEBI:28667)
IUPAC Name
(5Z,13E,15S)-9α,15-dihydroxy-11-oxothromboxa-5,13-dien-1-oic acid
Synonyms Sources
(5E)-7-[(2R,3S,4S)-4-hydroxy-2-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-6-oxooxan-3-yl]hept-5-enoic acid HMDB
11-Dehydro-thromboxane B2 KEGG COMPOUND
11-dehydro-TXB2 LIPID MAPS
11-Dehydro-txb2 ChemIDplus
11-dehydro-TXB2 ChEBI
11-Dehydrothromboxane HMDB
11-Dehydrothromboxane B2 ChemIDplus
11-DehydroTXB2 HMDB
11-Keto-thromboxane B2 ChemIDplus
Database Links Databases
C05964 KEGG COMPOUND
HMDB0004242 HMDB
LMFA03030004 LIPID MAPS
View more database links
Registry Numbers Types Sources
5826438 Reaxys Registry Number Reaxys
67910-12-7 CAS Registry Number KEGG COMPOUND
67910-12-7 CAS Registry Number ChemIDplus
Last Modified
08 June 2017