CHEBI:528967 - 1-O-(α-D-galactopyranosyl)-N-(6-phenylhexanoyl)phytosphingosine

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ChEBI Name 1-O-(α-D-galactopyranosyl)-N-(6-phenylhexanoyl)phytosphingosine
ChEBI ID CHEBI:528967
ChEBI ASCII Name 1-O-(alpha-D-galactopyranosyl)-N-(6-phenylhexanoyl)phytosphingosine
Definition A glycophytoceramide having an α-D-galactopyranosyl residue at the O-1 position and a 6-phenylhexanoyl group attached to the nitrogen.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C36H63NO9
Net Charge 0
Average Mass 653.88670
Monoisotopic Mass 653.45028
InChI InChI=1S/C36H63NO9/c1-2-3-4-5-6-7-8-9-10-11-12-18-23-29(39)32(41)28(26-45-36-35(44)34(43)33(42)30(25-38)46-36)37-31(40)24-19-14-17-22-27-20-15-13-16-21-27/h13,15-16,20-21,28-30,32-36,38-39,41-44H,2-12,14,17-19,22-26H2,1H3,(H,37,40)/t28-,29+,30+,32-,33-,34-,35+,36-/m0/s1
InChIKey OIUCZFOCUKYLRK-QNAIHFNASA-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)CCCCCc1ccccc1
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-(6-phenylhexanoyl)phytosphingosine (CHEBI:528967) has functional parent α-D-galactose (CHEBI:28061)
1-O-(α-D-galactopyranosyl)-N-(6-phenylhexanoyl)phytosphingosine (CHEBI:528967) is a glycophytoceramide (CHEBI:59389)
IUPAC Name
N-[(2S,3S,4R)-1-(α-D-galactopyranosyloxy)-3,4-dihydroxyoctadecan-2-yl]-6-phenylhexanamide
Synonyms Sources
C6Ph ChEBI
N-((2S,3S,4R)-3,4-dihydroxy-1-((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-tetrahydro-2H-pyran-2-yloxy)octadecan-2-yl)-6-phenylhexanamide ChEMBL
N-{(1S,2S,3R)-1-[(α-D-galactopyranosyloxy)methyl]- 2,3-dihydroxyheptadecyl}-6-phenylhexanamide IUPAC
Manual Xref Database
CA2683681 Patent
View more database links
Registry Number Type Source
10512158 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
17566107 PubMed citation ChEMBL
19732779 PubMed citation Europe PMC
20616071 PubMed citation Europe PMC
Last Modified
30 November 2017