ChEFS (Wedge)

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alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->2)-alpha-D-Manp-(1->6)-[alpha-Neup5Ac-(2->6)-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)-beta-D-GlcpNAc
A branched amino oligosaccharide (an undecasaccharide derivative) comprising a sequence of alpha-sialyl, beta-D-galactosyl, N-acetyl-beta-D-glucosaminyl, alpha-D-mannosyl, beta-D-mannosyl, N-acetyl-beta-D-glucosaminyl and N-acetyl-beta-D-glucosamine residues linked respectively (2->3), (1->4), (1->2), (1->6), (1->4) and (1->4), to the beta-D-mannosyl residue of which is also linked (1->3) an alpha-sialyl-(2->6)- beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->2)-beta-D-alpha-D-mannosyl branch.

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03. Biological Effects of Specific Chemicals

			epitope [CHEBI:53000] (470)

alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->2)-alpha-D-Manp-(1->6)-[alpha-Neup5Ac-(2->6)-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)-beta-D-GlcpNAc [CHEBI:72002] (1)

08. Chemical Category

			main group molecular entity [CHEBI:33579] (25650)

				p-block molecular entity [CHEBI:33675] (25343)

					chalcogen molecular entity [CHEBI:33304] (15225)

							oxygen molecular entity [CHEBI:25806] (14414)

									organooxygen compound [CHEBI:36963] (11352)

carbohydrate derivative [CHEBI:63299] (2582)

oligosaccharide derivative [CHEBI:63563] (804)

amino oligosaccharide [CHEBI:22483] (607)

glucosamine oligosaccharide [CHEBI:22485] (317)

							organochalcogen compound [CHEBI:36962] (11874)

								organooxygen compound [CHEBI:36963] (11352)

									carbohydrate derivative [CHEBI:63299] (2582)

oligosaccharide derivative [CHEBI:63563] (804)

amino oligosaccharide [CHEBI:22483] (607)

glucosamine oligosaccharide [CHEBI:22485] (317)

					carbon group molecular entity [CHEBI:33582] (23847)

						organic molecular entity [CHEBI:50860] (23769)

							heteroorganic entity [CHEBI:33285] (15197)

								organochalcogen compound [CHEBI:36962] (11874)

									organooxygen compound [CHEBI:36963] (11352)

carbohydrate derivative [CHEBI:63299] (2582)

oligosaccharide derivative [CHEBI:63563] (804)

amino oligosaccharide [CHEBI:22483] (607)

glucosamine oligosaccharide [CHEBI:22485] (317)

ChEBI Compound Accession Identifier:

[CHEBI:72002]

ChEBI Compound Description:

A branched amino oligosaccharide (an undecasaccharide derivative) comprising a sequence of alpha-sialyl, beta-D-galactosyl, N-acetyl-beta-D-glucosaminyl, alpha-D-mannosyl, beta-D-mannosyl, N-acetyl-beta-D-glucosaminyl and N-acetyl-beta-D-glucosamine residues linked respectively (2->3), (1->4), (1->2), (1->6), (1->4) and (1->4), to the beta-D-mannosyl residue of which is also linked (1->3) an alpha-sialyl-(2->6)- beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->2)-beta-D-alpha-D-mannosyl branch.

ChEBI Compound Identification Number:

72002

ChEBI InChI Value:

InChI=1S/C84H138N6O62/c1-20(100)85-39-26(106)7-83(81(128)129,150-66(39)45(110)28(108)9-91)133-19-38-49(114)56(121)59(124)76(142-38)144-63-34(15-97)140-75(44(54(63)119)90-25(6)105)149-71-58(123)48(113)31(12-94)137-80(71)147-68-51(116)37(141-77(60(68)125)145-64-35(16-98)138-73(42(53(64)118)88-23(4)103)143-62-33(14-96)134-72(127)41(52(62)117)87-22(3)102)18-132-79-70(57(122)47(112)30(11-93)136-79)148-74-43(89-24(5)104)55(120)65(36(17-99)139-74)146-78-61(126)69(50(115)32(13-95)135-78)152-84(82(130)131)8-27(107)40(86-21(2)101)67(151-84)46(111)29(109)10-92/h26-80,91-99,106-127H,7-19H2,1-6H3,(H,85,100)(H,86,101)(H,87,102)(H,88,103)(H,89,104)(H,90,105)(H,128,129)(H,130,131)/t26-,27-,28+,29+,30+,31+,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+,83+,84-/m0/s1

ChEBI InChIKey Value:

ZECFWZSUQLSCQU-LEBUUVDNSA-N

ChEBI Compound Name:

ChEBI SMILES Value:

[H][C@]1(O[C@@](C[C@H](O)[C@H]1NC(C)=O)(OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](NC(C)=O)[C@@H](O[C@@H]2CO)O[C@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]2O[C@H]2[C@H](O)[C@@H](CO[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@@]5(C[C@H](O)[C@@H](NC(C)=O)[C@@]([H])(O5)[C@H](O)[C@H](O)CO)C(O)=O)[C@H]4O)[C@H](O)[C@H]3NC(C)=O)O[C@@H](O[C@H]3[C@H](O)[C@@H](NC(C)=O)[C@@H](O[C@@H]3CO)O[C@H]3[C@H](O)[C@@H](NC(C)=O)[C@H](O)O[C@@H]3CO)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O)C(O)=O)[C@H](O)[C@H](O)CO

ChEBI Substance ID:

160962903

ChEBI URL:

ChEBI:72002

ChemSpider ID:

Ontomatica Chemical Accession Key (OnChAKey):

ZECFWZSUQLSCQU_LEBUUVDNSA_N_000_000000

PubChem Compound ID:

70788991