EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:186451 - UDP-3-(3R-hydroxy-tetradecanoyl)-alphaD-glucosamine

ChEBI IDCHEBI:186451
ChEBI NameUDP-3-(3R-hydroxy-tetradecanoyl)-alphaD-glucosamine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H51N3O18P2
Net Charge0
Average Mass791.678
Monoisotopic Mass791.26429
SMILESCCCCCCCCCCC[C@@H](O)CC(=O)O[C@@H]1C(N)[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)nc3=O)[C@@H](O)C2O)OC(CO)[C@H]1O
InChIInChI=1S/C29H51N3O18P2/c1-2-3-4-5-6-7-8-9-10-11-17(34)14-21(36)48-26-22(30)28(47-18(15-33)24(26)38)49-52(43,44)50-51(41,42)45-16-19-23(37)25(39)27(46-19)32-13-12-20(35)31-29(32)40/h12-13,17-19,22-28,33-34,37-39H,2-11,14-16,30H2,1H3,(H,41,42)(H,43,44)(H,31,35,40)/t17-,18?,19-,22?,23?,24-,25+,26-,27-,28-/m1/s1
InChIKeyZFPNNOXCEDQJQS-YVZQRBIDSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
UDP-3-(3R-hydroxy-tetradecanoyl)-alphaD-glucosamine (CHEBI:186451) is a pyrimidine nucleotide-sugar (CHEBI:61109)
IUPAC Name 
[(2R,4R,5S)-3-amino-2-[[[(2R,4S,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-4-yl] (3R)-3-hydroxytetradecanoate
Manual XrefsDatabases
2497504ChemSpider
LMSL01010001LIPID MAPS