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CHEBI:230379 - DG(15:0/TXB2/0:0)

ChEBI IDCHEBI:230379
ChEBI NameDG(15:0/TXB2/0:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC38H68O9
Net Charge0
Average Mass668.953
Monoisotopic Mass668.48633
SMILESCCCCCCCCCCCCCCC(=O)OC[C@H](CO)OC(=O)CCC/C=C\C[C@H]1[C@@H](O)CC(O)O[C@@H]1/C=C/[C@@H](O)CCCCC
InChIInChI=1S/C38H68O9/c1-3-5-7-8-9-10-11-12-13-14-15-20-24-36(42)45-30-32(29-39)46-37(43)25-21-17-16-19-23-33-34(41)28-38(44)47-35(33)27-26-31(40)22-18-6-4-2/h16,19,26-27,31-35,38-41,44H,3-15,17-18,20-25,28-30H2,1-2H3/b19-16-,27-26+/t31-,32-,33-,34-,35+,38?/m0/s1
InChIKeyCFMXSCMHQWMIFM-BJGPBGKBSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
DG(15:0/TXB2/0:0) (CHEBI:230379) is a thromboxane (CHEBI:26995)
IUPAC Name 
[(2S)-2-[(Z)-7-[(2R,3S,4S)-4,6-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]oxan-3-yl]hept-5-enoyl]oxy-3-hydroxypropyl] pentadecanoate
Manual XrefsDatabases
117214470ChemSpider
HMDB0295267HMDB