CHEBI:528968 - 1-O-(α-D-galactopyranosyl)-N-(8-phenyloctanoyl)phytosphingosine

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ChEBI Name 1-O-(α-D-galactopyranosyl)-N-(8-phenyloctanoyl)phytosphingosine
ChEBI ID CHEBI:528968
ChEBI ASCII Name 1-O-(alpha-D-galactopyranosyl)-N-(8-phenyloctanoyl)phytosphingosine
Definition A glycophytoceramide having an α-D-galactopyranosyl residue at the O-1 position and an 8-phenyloctanoyl group attached to the nitrogen.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C38H67NO9
Net Charge 0
Average Mass 681.93990
Monoisotopic Mass 681.48158
InChI InChI=1S/C38H67NO9/c1-2-3-4-5-6-7-8-9-10-11-14-20-25-31(41)34(43)30(28-47-38-37(46)36(45)35(44)32(27-40)48-38)39-33(42)26-21-15-12-13-17-22-29-23-18-16-19-24-29/h16,18-19,23-24,30-32,34-38,40-41,43-46H,2-15,17,20-22,25-28H2,1H3,(H,39,42)/t30-,31+,32+,34-,35-,36-,37+,38-/m0/s1
InChIKey YEKLGTQAMSELFI-ZORUMLJWSA-N
SMILES CCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@H](CO[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCc1ccccc1
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-(8-phenyloctanoyl)phytosphingosine (CHEBI:528968) has functional parent α-D-galactose (CHEBI:28061)
1-O-(α-D-galactopyranosyl)-N-(8-phenyloctanoyl)phytosphingosine (CHEBI:528968) is a glycophytoceramide (CHEBI:59389)
IUPAC Names
C8Ph
N-[(2S,3S,4R)-1-(α-D-galactopyranosyloxy)-3,4-dihydroxyoctadecan-2-yl]-8-phenyloctanamide
Synonym Source
N-{(1S,2S,3R)-1-[(α-D-galactopyranosyloxy)methyl]- 2,3-dihydroxyheptadecyl}-8-phenyloctanamide IUPAC
Manual Xref Database
CA2683681 Patent
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Registry Number Type Source
10512989 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
19732779 PubMed citation Europe PMC
20616071 PubMed citation Europe PMC
Last Modified
04 December 2017