CHEBI:53495 - D-GalNAc-(1→4)-D-GlcNAc-(1→3)-[D-GalNAc-(1→4)-D-GlcNAc-(1→6)]-D-GalNAc-ol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name D-GalNAc-(1→4)-D-GlcNAc-(1→3)-[D-GalNAc-(1→4)-D-GlcNAc-(1→6)]-D-GalNAc-ol
ChEBI ID CHEBI:53495
ChEBI ASCII Name D-GalNAc-(1->4)-D-GlcNAc-(1->3)-[D-GalNAc-(1->4)-D-GlcNAc-(1->6)]-D-GalNAc-ol
Definition An oligosaccharide derivative consisting of -D-GalNAc-ol at the reducing end with two D-GalNAc-(1→4)-D-GlcNAc moities attached via (1→3)- and (1→6)-linkages.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C40H69N5O26
Net Charge 0
Average Mass 1035.99380
Monoisotopic Mass 1035.42308
InChI InChI=1S/C40H69N5O26/c1-12(51)41-17(6-46)34(69-40-26(45-16(5)55)33(63)36(22(10-50)68-40)71-39-24(43-14(3)53)31(61)29(59)20(8-48)66-39)27(57)18(56)11-64-37-25(44-15(4)54)32(62)35(21(9-49)67-37)70-38-23(42-13(2)52)30(60)28(58)19(7-47)65-38/h17-40,46-50,56-63H,6-11H2,1-5H3,(H,41,51)(H,42,52)(H,43,53)(H,44,54)(H,45,55)/t17-,18+,19+,20+,21+,22+,23+,24+,25+,26+,27-,28-,29-,30+,31+,32+,33+,34+,35+,36+,37?,38?,39?,40?/m0/s1
InChIKey BEMKYWCTWHPNFW-GULFZJIVSA-N
SMILES CC(=O)N[C@@H](CO)[C@@H](OC1O[C@H](CO)[C@@H](OC2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2NC(C)=O)[C@H](O)[C@H]1NC(C)=O)[C@@H](O)[C@H](O)COC1O[C@H](CO)[C@@H](OC2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2NC(C)=O)[C@H](O)[C@H]1NC(C)=O
Roles Classification
Biological Role(s): carbohydrate allergen
Any carbohydrate, carbohydrate derivative or derived substituent group which causes the onset of an allergic reaction.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing D-GalNAc-(1→4)-D-GlcNAc-(1→3)-[D-GalNAc-(1→4)-D-GlcNAc-(1→6)]-D-GalNAc-ol (CHEBI:53495) has role carbohydrate allergen (CHEBI:143231)
D-GalNAc-(1→4)-D-GlcNAc-(1→3)-[D-GalNAc-(1→4)-D-GlcNAc-(1→6)]-D-GalNAc-ol (CHEBI:53495) is a glucosamine oligosaccharide (CHEBI:22485)
D-GalNAc-(1→4)-D-GlcNAc-(1→3)-[D-GalNAc-(1→4)-D-GlcNAc-(1→6)]-D-GalNAc-ol (CHEBI:53495) is a oligosaccharide derivative (CHEBI:63563)
IUPAC Name
2-acetamido-2-deoxy-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-D-glucopyranosyl-(1→3)-[2-acetamido-2-deoxy-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-D-glucopyranosyl-(1→6)]-2-acetamido-2-deoxy-D-galactitol
Synonyms Sources
D-GalpNAc-(1→4)-D-GlcpNAc-(1→3)-[D-GalpNAc-(1→4)-D-GlcpNAc-(1→6)]-D-GalNAc-ol JCBN
HPG-Beta2-N6 ChEBI
Citation Waiting for Citations Type Source
2817893 PubMed citation Europe PMC
Last Modified
20 May 2020