N-hexacosanoylisoglobotriaosyl ceramide (CHEBI:73269)

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CHEBI:73269 - N-hexacosanoylisoglobotriaosyl ceramide

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ChEBI ID	CHEBI:73269
ChEBI Name	N-hexacosanoylisoglobotriaosyl ceramide
Stars
ASCII Name	N-hexacosanoylisoglobotriaosyl ceramide
Definition	The N-hexacosanoyl derivative of isoglobotriaosyl ceramide.
Secondary ChEBI ID	CHEBI:73449
Last Modified	27 August 2013
Submitter	Marcus Ennis
Downloads	Molfile

Formula	C62H117NO18
Net Charge	0
Average Mass	1164.607
Monoisotopic Mass	1163.82707
SMILES	CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H]2O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC
InChI	InChI=1S/C62H117NO18/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-40-50(68)63-45(46(67)39-37-35-33-31-29-27-16-14-12-10-8-6-4-2)44-76-60-56(74)54(72)58(49(43-66)79-60)80-62-57(75)59(52(70)48(42-65)78-62)81-61-55(73)53(71)51(69)47(41-64)77-61/h37,39,45-49,51-62,64-67,69-75H,3-36,38,40-44H2,1-2H3,(H,63,68)/b39-37+/t45-,46+,47+,48+,49+,51-,52-,53-,54+,55+,56+,57+,58+,59-,60+,61+,62-/m0/s1
InChIKey	JMENXJYBCQFIRK-KRJDXUSZSA-N

Roles Classification

Biological Role:

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).

ChEBI Ontology

Outgoing Relation(s)
	N-hexacosanoylisoglobotriaosyl ceramide (CHEBI:73269) has role antigen (CHEBI:59132)
	N-hexacosanoylisoglobotriaosyl ceramide (CHEBI:73269) is a α-D-Galp-(1→3)-β-D-Galp-(1→4)-β-D-Glcp-(1↔1')-Cer (CHEBI:52570)

IUPAC Name
N-[(2S,3R,4E)-1-{[α-D-galactopyranosyl-(1→3)-β-D-galactopyranosyl-(1→4)-β-D-glucopyranosyl]oxy}-3-hydroxyoctadec-4-en-2-yl]hexacosanamide

Synonyms	Source
iGb3	ChEBI
isoglobotrihexosylceramide	ChEBI
α-D-galactosyl-(1→3)-β-D-galactosyl-(1→4)-β-D-glucosyl-N-(hexacosanoyl)sphingosine	ChEBI

Registry Numbers	Sources
Reaxys:10327819	Reaxys

Citations