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CHEBI:165346 - 11-Dehydro-2,3-dinor-TXB2

Default Structure
ChEBI IDCHEBI:165346
ChEBI Name11-Dehydro-2,3-dinor-TXB2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H28O6
Net Charge0
Average Mass340.416
Monoisotopic Mass340.18859
SMILESCCCCC[C@H](O)/C=C/[C@H]1OC(=O)C[C@H](O)[C@@H]1C/C=C\CC(=O)O
InChIInChI=1S/C18H28O6/c1-2-3-4-7-13(19)10-11-16-14(8-5-6-9-17(21)22)15(20)12-18(23)24-16/h5-6,10-11,13-16,19-20H,2-4,7-9,12H2,1H3,(H,21,22)/b6-5-,11-10+/t13-,14-,15-,16+/m0/s1
InChIKeyPJAAKFHMQLYVGV-YCEKRRLLSA-N
ChEBI Ontology
Outgoing Relation(s)
11-Dehydro-2,3-dinor-TXB2 (CHEBI:165346) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
(Z)-5-[(2R,3S,4S)-4-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-6-oxooxan-3-yl]pent-3-enoic acid
Manual XrefsDatabases
32816274ChemSpider
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