CHEBI:176872 - alpha,alpha'-Trehalose 6-palmitate

ChEBI IDCHEBI:176872
ChEBI Namealpha,alpha'-Trehalose 6-palmitate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H52O12
Net Charge0
Average Mass580.712
Monoisotopic Mass580.34588
SMILESCCCCCCCCCCCCCCCC(=O)OC[C@H]1O[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C28H52O12/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20(30)37-17-19-22(32)24(34)26(36)28(39-19)40-27-25(35)23(33)21(31)18(16-29)38-27/h18-19,21-29,31-36H,2-17H2,1H3/t18-,19-,21-,22-,23+,24+,25-,26-,27-,28-/m1/s1
InChIKeyVNHFMAKRYDWMAF-FJUFGMPQSA-N
Species of MetaboliteComponentSourceComments
Trypanosoma congolense (ncbitaxon:5692) Whole Organism (NCIT:C13413) MetaboLights (MTBLS2372)
ChEBI Ontology
Outgoing Relation(s)
alpha,alpha'-Trehalose 6-palmitate (CHEBI:176872) is a lipopolysaccharide (CHEBI:16412)
IUPAC Name 
[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl hexadecanoate
Manual XrefsDatabases
30791404ChemSpider
C04265KEGG COMPOUND