CHEBI:139167 - 1-O-(α-D-galactopyranosyl)-N-(11-phenylundecanoyl)phytosphingosine

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ChEBI Name 1-O-(α-D-galactopyranosyl)-N-(11-phenylundecanoyl)phytosphingosine
ChEBI ID CHEBI:139167
ChEBI ASCII Name 1-O-(alpha-D-galactopyranosyl)-N-(11-phenylundecanoyl)phytosphingosine
Definition A glycophytoceramide having an α-D-galactopyranosyl residue at the O-1 position and an 11-phenylundecanoyl group attached to the nitrogen.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C41H73NO9
Net Charge 0
Average Mass 724.021
Monoisotopic Mass 723.52853
InChI InChI=1S/C41H73NO9/c1-2-3-4-5-6-7-8-9-10-14-17-23-28-34(44)37(46)33(31-50-41-40(49)39(48)38(47)35(30-43)51-41)42-36(45)29-24-18-15-12-11-13-16-20-25-32-26-21-19-22-27-32/h19,21-22,26-27,33-35,37-41,43-44,46-49H,2-18,20,23-25,28-31H2,1H3,(H,42,45)/t33-,34+,35+,37-,38-,39-,40+,41-/m0/s1
InChIKey ZIILJLJQJDTYAX-IWVUWWQKSA-N
SMILES [C@H]1([C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)OC[C@@H]([C@@H]([C@@H](CCCCCCCCCCCCCC)O)O)NC(CCCCCCCCCCC=2C=CC=CC2)=O
Roles Classification
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
(via N-acylphytosphingosine )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1-O-(α-D-galactopyranosyl)-N-(11-phenylundecanoyl)phytosphingosine (CHEBI:139167) has functional parent α-D-galactose (CHEBI:28061)
1-O-(α-D-galactopyranosyl)-N-(11-phenylundecanoyl)phytosphingosine (CHEBI:139167) is a glycophytoceramide (CHEBI:59389)
IUPAC Name
N-[(2S,3S,4R)-1-(α-D-galactopyranosyloxy)-3,4-dihydroxyoctadecan-2-yl]-11-phenylundecanamide
Synonym Source
N-{(1S,2S,3R)-1-[(α-D-galactopyranosyloxy)methyl]- 2,3-dihydroxyheptadecyl}-11-phenylundecanamide IUPAC
Manual Xrefs Databases
CA2683681 Patent
WO2007035717 Patent
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Registry Number Type Source
10514065 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
16834361 PubMed citation Europe PMC
20616071 PubMed citation Europe PMC
Last Modified
30 November 2017