CHEBI:146263 - N-(3-{[α-D-GalN-(1→4)-α-D-GalN-(1→4)-α-D-GalN-yl]oxy}propyl)-21-(biotinylamino)-4,7,10,13,16,19-hexaoxadodecan-1-amide

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ChEBI Name N-(3-{[α-D-GalN-(1→4)-α-D-GalN-(1→4)-α-D-GalN-yl]oxy}propyl)-21-(biotinylamino)-4,7,10,13,16,19-hexaoxadodecan-1-amide ChEBI ID CHEBI:146263 ChEBI ASCII Name N-(3-{[alpha-D-GalN-(1->4)-alpha-D-GalN-(1->4)-alpha-D-GalN-yl]oxy}propyl)-21-(biotinylamino)-4,7,10,13,16,19-hexaoxadodecan-1-amide Definition A trisaccharide derivative in which α-D-galactosaminyl-(1→4)-α-D-galactosaminyl-(1→4)-α-D-galactosamine is linked glycosidically to biotin via a (21-oxo-3,6,9,12,15,18-hexaoxa-22-azapentacosan-1-yl)amino spacer. One of a set of synthesised biotinylated oligo-α-(1→4)-D-galactosamines comprising from two to six monosaccharide units, along with their N-acetylated derivatives (PMID:31913631), aimed at analysing the specificity of the antibody responses to a complex exopolysaccharide galactosaminogalactan found in Aspergillus fumigatus, the most important airborne human fungal pathogen in industrialized countries. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C46H85N7O22S Net Charge 0 Average Mass 1120.270 Monoisotopic Mass 1119.54684 InChI InChI=1S/C46H85N7O22S/c47-33-38(60)37(59)27(22-54)71-44(33)74-42-29(24-56)73-45(35(49)40(42)62)75-41-28(23-55)72-43(34(48)39(41)61)70-9-3-7-50-32(58)6-10-64-12-14-66-16-18-68-20-21-69-19-17-67-15-13-65-11-8-51-31(57)5-2-1-4-30-36-26(25-76-30)52-46(63)53-36/h26-30,33-45,54-56,59-62H,1-25,47-49H2,(H,50,58)(H,51,57)(H2,52,53,63)/t26-,27+,28+,29+,30-,33+,34+,35+,36-,37-,38+,39+,40+,41-,42-,43-,44+,45+/m0/s1 InChIKey JSVPUGSZZUAPSX-UJIDSKHPSA-N SMILES [C@H]1([C@@H]([C@H]([C@H]([C@H](O1)CO)O[C@@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)N)O)N)O[C@@H]3[C@@H]([C@H]([C@H](O[C@@H]3CO)OCCCNC(CCOCCOCCOCCOCCOCCOCCNC(CCCC[C@H]4[C@]5(NC(N[C@]5(CS4)[H])=O)[H])=O)=O)N)O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing N-(3-{[α-D-GalN-(1→4)-α-D-GalN-(1→4)-α-D-GalN-yl]oxy}propyl)-21-(biotinylamino)-4,7,10,13,16,19-hexaoxadodecan-1-amide (CHEBI:146263) is a biotins (CHEBI:51570) N-(3-{[α-D-GalN-(1→4)-α-D-GalN-(1→4)-α-D-GalN-yl]oxy}propyl)-21-(biotinylamino)-4,7,10,13,16,19-hexaoxadodecan-1-amide (CHEBI:146263) is a trisaccharide derivative (CHEBI:63571) IUPAC Name N-(3-{[2-amino-2-deoxy-α-D-galactopyranosyl-(1→4)-2-amino-2-deoxy-α-D-galactopyranosyl-(1→4)-2-amino-2-deoxy-α-D-galactopyranosyl]oxy}propyl)-23-oxo-27-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]-4,7,10,13,16,19-hexaoxa-22-azaheptacosan-1-amide Synonyms Sources (3aS,4S,6aR)-N-[25-[[O-2-amino-2-deoxy-α-D-galactopyranosyl-(1→4)-O-2-amino-2-deoxy-α-D-galactopyranosyl-(1→4)-2-amino-2-deoxy-α-D-galactopyranosyl]oxy]-21-oxo-3,6,9,12,15,18-hexaoxa-22-azapentacos-1-yl]hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanamide ChEBI 3-(21-biotinamino-4,7,10,13,16,19-hexaoxagenicaminoamino)-propyl 2-amino-2-deoxy-α-D-galactopyranosyl-(1→4)-2-amino-2-deoxy-α-D-galactopyranosyl-(1→4)-2-amino-2-deoxy-α-D-galactopyranoside ChEBI N-(3-{[α-D-galactosaminyl-(1→4)-α-D-galactosaminyl-(1→4)-α-D-galactosaminyl]oxy}propyl)-21-(biotinylamino)-4,7,10,13,16,19-hexaoxaheptacosan-1-amide ChEBI Citation Type Source 31913631 PubMed citation Europe PMC Last Modified 06 March 2020