CHEBI:204988 - 2-(Tetradecanoylamino)-3-methylbutyric acid 2-deoxy-2-(butyrylamino)-alpha-D-glucopyranosyl ester

ChEBI IDCHEBI:204988
ChEBI Name2-(Tetradecanoylamino)-3-methylbutyric acid 2-deoxy-2-(butyrylamino)-alpha-D-glucopyranosyl ester
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H54N2O8
Net Charge0
Average Mass558.757
Monoisotopic Mass558.38802
SMILESCCCCCCCCCCCCCC(=O)NC(C(=O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NC(=O)CCC)C(C)C
InChIInChI=1S/C29H54N2O8/c1-5-7-8-9-10-11-12-13-14-15-16-18-23(34)30-24(20(3)4)28(37)39-29-25(31-22(33)17-6-2)27(36)26(35)21(19-32)38-29/h20-21,24-27,29,32,35-36H,5-19H2,1-4H3,(H,30,34)(H,31,33)/t21-,24?,25-,26-,27-,29-/m1/s1
InChIKeyLGELFTOGZAFDTM-TVFZEBHCSA-N
Species of MetaboliteComponentSourceComments
Serratiaspecies (in: enterobacteria) (ncbitaxon:616) - PubMed (18303848)
ChEBI Ontology
Outgoing Relation(s)
2-(Tetradecanoylamino)-3-methylbutyric acid 2-deoxy-2-(butyrylamino)-alpha-D-glucopyranosyl ester (CHEBI:204988) is a amino sugar (CHEBI:28963)
IUPAC Name 
[(2R,3R,4R,5S,6R)-3-(butanoylamino)-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-methyl-2-(tetradecanoylamino)butanoate
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