1-O-(alpha-D-galactopyranuronosyl)-N-tetradecanoyldihydrosphingosine (CHEBI:528825)

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CHEBI:528825 - 1-O-(α-D-galactopyranuronosyl)-N-tetradecanoyldihydrosphingosine

ChEBI ID	CHEBI:528825
ChEBI Name	1-O-(α-D-galactopyranuronosyl)-N-tetradecanoyldihydrosphingosine
Stars
ASCII Name	1-O-(alpha-D-galactopyranuronosyl)-N-tetradecanoyldihydrosphingosine
Definition	A glycodihydroceramide having an α-D-galacturonic acid residue at the O-1 position and a tetradecanoyl group attached to the nitrogen.
Secondary ChEBI IDs	CHEBI:42910, CHEBI:60452
Last Modified	26 February 2018
Submitter	Steve
Downloads	Molfile

Formula	C38H73NO9
Net Charge	0
Average Mass	688.000
Monoisotopic Mass	687.52853
SMILES	CCCCCCCCCCCCCCC[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
InChI	InChI=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
InChIKey	IRPOZWRRAFKYMQ-LMIAXWKISA-N

Roles Classification

Biological Roles:

epitope The biological role played by a material entity when bound by a receptor of the adaptive immune system. Specific site on an antigen to which an antibody binds.

antigen Any substance that stimulates an immune response in the body, such as through antibody production or by presentation to a T-cell receptor after binding to a major histocompability complex (MHC).

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-galactopyranuronosyl)-N-tetradecanoyldihydrosphingosine (CHEBI:528825) has role antigen (CHEBI:59132)
	1-O-(α-D-galactopyranuronosyl)-N-tetradecanoyldihydrosphingosine (CHEBI:528825) has role epitope (CHEBI:53000)
	1-O-(α-D-galactopyranuronosyl)-N-tetradecanoyldihydrosphingosine (CHEBI:528825) is a glycodihydroceramide (CHEBI:60451)

IUPAC Name
(2S,3R)-3-hydroxy-2-(tetradecanoylamino)octadecyl α-D-galactopyranosiduronic acid

Synonyms	Source
GalA-GSL	ChEBI
GSL-1	ChEBI

Manual Xrefs	Databases
GSL	PDBeChem

Registry Numbers	Sources
Beilstein:10232866	Beilstein
Reaxys:10232866	Reaxys

Citations