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CHEBI:85892 - β-D-GlcpNAc-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→2)-[β-D-GlcpNAc-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→6)]-α-D-Manp-(1→6)-[β-D-GlcpNAc-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)]-β-D-Manp-(1→4)-β-D-GlcpNAc-(1→4)-D-GlcpNAc

ChEBI IDCHEBI:85892
ChEBI Nameβ-D-GlcpNAc-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→2)-[β-D-GlcpNAc-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→6)]-α-D-Manp-(1→6)-[β-D-GlcpNAc-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)]-β-D-Manp-(1→4)-β-D-GlcpNAc-(1→4)-D-GlcpNAc
Stars
ASCII Namebeta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->2)-[beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->6)]-alpha-D-Manp-(1->6)-[beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->2)-alpha-D-Manp-(1->3)]-beta-D-Manp-(1->4)-beta-D-GlcpNAc-(1->4)-D-GlcpNAc
DefinitionA branched amino oligosaccharide (tetradecasaccharide) consisting of a linear trisaccharide unit of β-D-mannose, N-acetyl-β-D-glucosamine and N-acetyl-D-glucosamine residues, connected by (1→3) linkages, to the β-D-mannose residue of which are linked (1→3) and (1→6) α-D-mannose residues, the one at O-2 being substituted at O-2 by an N-acetyl-β-D-glucosaminyl-(1→3)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl trisaccharide unit and the one at O-6 being substituted also at both O-2 and O-6 by N-acetyl-β-D-glucosaminyl-(1→3)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl trisaccharide units.
Last Modified26 June 2023
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC100H166N8O71
Net Charge0
Average Mass2616.413
Monoisotopic Mass2614.96249
SMILESCC(=O)N[C@H]1[C@H](O[C@H]2[C@H](O)[C@@H](NC(C)=O)C(O)O[C@@H]2CO)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO[C@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6NC(C)=O)[C@H]5O)[C@H](O)[C@H]4NC(C)=O)[C@@H](O)[C@H](O)[C@@H]3O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5NC(C)=O)[C@H]4O)[C@H](O)[C@H]3NC(C)=O)[C@@H](O)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5NC(C)=O)[C@H]4O)[C@H](O)[C@H]3NC(C)=O)[C@@H]2O)[C@@H]1O
InChIInChI=1S/C100H166N8O71/c1-23(121)101-45-65(141)76(38(16-116)155-87(45)152)169-92-50(106-28(6)126)67(143)80(40(18-118)164-92)173-98-75(151)84(177-100-86(70(146)56(132)34(12-112)162-100)179-94-52(108-30(8)128)69(145)79(42(20-120)166-94)172-97-74(150)83(60(136)37(15-115)161-97)176-91-48(104-26(4)124)64(140)55(131)33(11-111)158-91)61(137)44(167-98)22-154-99-85(178-93-51(107-29(7)127)68(144)78(41(19-119)165-93)171-96-73(149)82(59(135)36(14-114)160-96)175-90-47(103-25(3)123)63(139)54(130)32(10-110)157-90)71(147)57(133)43(168-99)21-153-88-49(105-27(5)125)66(142)77(39(17-117)163-88)170-95-72(148)81(58(134)35(13-113)159-95)174-89-46(102-24(2)122)62(138)53(129)31(9-109)156-89/h31-100,109-120,129-152H,9-22H2,1-8H3,(H,101,121)(H,102,122)(H,103,123)(H,104,124)(H,105,125)(H,106,126)(H,107,127)(H,108,128)/t31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58+,59+,60+,61-,62-,63-,64-,65-,66-,67-,68-,69-,70+,71+,72-,73-,74-,75+,76-,77-,78-,79-,80-,81+,82+,83+,84+,85+,86+,87?,88-,89+,90+,91+,92+,93+,94+,95+,96+,97+,98+,99+,100-/m1/s1
InChIKeyLUHAZEANDKJTNI-RSPGEAQFSA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-GlcpNAc-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→2)-[β-D-GlcpNAc-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→6)]-α-D-Manp-(1→6)-[β-D-GlcpNAc-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)]-β-D-Manp-(1→4)-β-D-GlcpNAc-(1→4)-D-GlcpNAc (CHEBI:85892) is a amino oligosaccharide (CHEBI:22483)
IUPAC Name 
2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→3)-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→2)-[2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→3)-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→6)]-α-D-mannopyranosyl-(1→6)-[2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→3)-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→2)-α-D-mannopyranosyl-(1→3)]-β-D-mannopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→4)-2-acetamido-2-deoxy-D-glucopyranose
Synonyms  Source
β-D-GlcNAc-(1→3)-β-D-Gal-(1→4)-β-D-GlcNAc-(1→2)-[β-D-GlcNAc-(1→3)-β-D-Gal-(1→4)-β-D-GlcNAc-(1→6)]-α-D-Man-(1→6)-[β-D-GlcNAc-(1→3)-β-D-Gal-(1→4)-β-D-GlcNAc-(1→2)-α-D-Man-(1→3)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAcChEBI
N-acetyl-β-D-glucosaminyl-(1→3)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→2)-[N-acetyl-β-D-glucosaminyl-(1→3)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→6)]-α-D-mannosyl-(1→6)-[N-acetyl-β-D-glucosaminyl-(1→3)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→2)-α-D-mannosyl-(1→3)]-β-D-mannosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→4)-N-acetyl-D-glucosamineChEBI
GlcNAcb1-3Galb1-4GlcNAcb1-2(GlcNAcb1-3Galb1-4GlcNAcb1-6)Mana1-6(GlcNAcb1-3Galb1-4GlcNAcb1-2Mana1-3)Manb1-4GlcNAcb1-4GlcNAcChEBI
GlcNAcb1-3Galb1-4GlcNAcb1-6(GlcNAcb1-3Galb1-4GlcNAcb1-2)Mana1-6(GlcNAcb1-3Galb1-4GlcNAcb1-2Mana1-3)Manb1-4GlcNAcb1-4GlcNAcChEBI
GlcNAcβ1-3Galβ1-4GlcNAcβ1-6(GlcNAcβ1-3Galβ1-4GlcNAcβ1-2)Manα1-6(GlcNAcβ1-3Galβ1-4GlcNAcβ1-2Manα1-3)Manb1-4GlcNAcβ1-4GlcNAcChEBI
GlcNAcβ1-3Galβ1-4GlcNAcβ1-2(GlcNAcβ1-3Galβ1-4GlcNAcβ1-6)Manα1-6(GlcNAcβ1-3Galβ1-4GlcNAcβ1-2Manα1-3)Manb1-4GlcNAcβ1-4GlcNAcChEBI
Citations