EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:60476 - 1-O-(α-D-glucopyranuronosyl)-N-tetradecanoyldihydrosphingosine

ChEBI IDCHEBI:60476
ChEBI Name1-O-(α-D-glucopyranuronosyl)-N-tetradecanoyldihydrosphingosine
Stars
ASCII Name1-O-(alpha-D-glucopyranuronosyl)-N-tetradecanoyldihydrosphingosine
DefinitionA glycodihydroceramide having an α-D-glucuronic acid residue at the O-1 position and a tetradecanoyl group attached to the nitrogen.
Last Modified20 October 2010
SubmitterSteve
DownloadsMolfile
FormulaC38H73NO9
Net Charge0
Average Mass688.000
Monoisotopic Mass687.52853
SMILESCCCCCCCCCCCCCCC[C@@H](O)[C@H](CO[C@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCCCC
InChIInChI=1S/C38H73NO9/c1-3-5-7-9-11-13-15-16-18-19-21-23-25-27-31(40)30(29-47-38-35(44)33(42)34(43)36(48-38)37(45)46)39-32(41)28-26-24-22-20-17-14-12-10-8-6-4-2/h30-31,33-36,38,40,42-44H,3-29H2,1-2H3,(H,39,41)(H,45,46)/t30-,31+,33-,34-,35+,36-,38-/m0/s1
InChIKeyIRPOZWRRAFKYMQ-QFXMZCDLSA-N
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
1-O-(α-D-glucopyranuronosyl)-N-tetradecanoyldihydrosphingosine (CHEBI:60476) has functional parent D-glucopyranuronic acid (CHEBI:47952)
1-O-(α-D-glucopyranuronosyl)-N-tetradecanoyldihydrosphingosine (CHEBI:60476) is a glycodihydroceramide (CHEBI:60451)
IUPAC Name 
(2S,3R)-3-hydroxy-2-(tetradecanoylamino)octadecyl α-D-glucopyranosiduronic acid
Synonym  Source
α-glucuronyl ceramideChEBI
Citations