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CHEBI:176172 - 12-O-D-Glucuronoside-13-hydroxyoctadec-9Z-enoate

ChEBI IDCHEBI:176172
ChEBI Name12-O-D-Glucuronoside-13-hydroxyoctadec-9Z-enoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H42O10
Net Charge0
Average Mass490.590
Monoisotopic Mass490.27780
SMILESCCCCC[C@@H](O[C@@H]1O[C@@H](C(=O)O)[C@@H](O)[C@@H](O)[C@H]1O)[C@H](O)C/C=C\CCCCCCCC(=O)O
InChIInChI=1S/C24H42O10/c1-2-3-10-14-17(33-24-21(30)19(28)20(29)22(34-24)23(31)32)16(25)13-11-8-6-4-5-7-9-12-15-18(26)27/h8,11,16-17,19-22,24-25,28-30H,2-7,9-10,12-15H2,1H3,(H,26,27)(H,31,32)/b11-8-/t16-,17-,19-,20+,21-,22-,24-/m1/s1
InChIKeyZWDYIYOIBZOENK-YZGJGUBNSA-N
ChEBI Ontology
Outgoing Relation(s)
12-O-D-Glucuronoside-13-hydroxyoctadec-9Z-enoate (CHEBI:176172) is a lipopolysaccharide (CHEBI:16412)
IUPAC Name 
(2R,3S,4R,5R,6R)-6-[(Z,6R,7R)-17-carboxy-7-hydroxyheptadec-9-en-6-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Manual XrefsDatabases
30778538ChemSpider
HMDB0060119HMDB