ChEFS (Wedge)

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alpha-D-Gal-(1->3)-beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-{alpha-D-Gal-(1->3)-beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)}-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc
An amino oligosaccharide that is a tridecasaccharide derivative in which two pentasaccharide branches, each formed from alpha-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-[alpha-L-fucosyl-(1->3)]-N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannose, are linked (1->3) and (1->6) to the mannose residue of a trisaccharide chain consisting of mannose and two N-acetylglucosamine residues all linked beta(1->4) with a beta-configuration of the anomeric carbon of the N-acetylglucosamine residue at the reducing end.

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03. Biological Effects of Specific Chemicals

			epitope [CHEBI:53000] (470)

alpha-D-Gal-(1->3)-beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-{alpha-D-Gal-(1->3)-beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)}-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc [CHEBI:68470] (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:68470]

ChEBI Compound Description:

An amino oligosaccharide that is a tridecasaccharide derivative in which two pentasaccharide branches, each formed from alpha-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-[alpha-L-fucosyl-(1->3)]-N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannose, are linked (1->3) and (1->6) to the mannose residue of a trisaccharide chain consisting of mannose and two N-acetylglucosamine residues all linked beta(1->4) with a beta-configuration of the anomeric carbon of the N-acetylglucosamine residue at the reducing end.

ChEBI Compound Identification Number:

68470

ChEBI InChI Value:

InChI=1S/C86H144N4O64/c1-18-39(105)50(116)56(122)78(131-18)148-67-37(89-22(5)103)76(141-32(15-99)65(67)146-82-60(126)69(45(111)28(11-95)136-82)150-80-58(124)52(118)41(107)24(7-91)134-80)153-72-54(120)43(109)26(9-93)138-85(72)130-17-34-47(113)71(62(128)84(143-34)145-64-31(14-98)140-75(36(49(64)115)88-21(4)102)144-63-30(13-97)133-74(129)35(48(63)114)87-20(3)101)152-86-73(55(121)44(110)27(10-94)139-86)154-77-38(90-23(6)104)68(149-79-57(123)51(117)40(106)19(2)132-79)66(33(16-100)142-77)147-83-61(127)70(46(112)29(12-96)137-83)151-81-59(125)53(119)42(108)25(8-92)135-81/h18-19,24-86,91-100,105-129H,7-17H2,1-6H3,(H,87,101)(H,88,102)(H,89,103)(H,90,104)/t18-,19-,24+,25+,26+,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+,81+,82-,83-,84-,85-,86+/m0/s1

ChEBI InChIKey Value:

MVVKDAFIBQQWLI-QDRYHIDQSA-N

ChEBI Compound Name:

ChEBI SMILES Value:

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

ChEBI Substance ID:

160645855

ChEBI URL:

ChEBI:68470

ChemSpider ID:

Ontomatica Chemical Accession Key (OnChAKey):

MVVKDAFIBQQWLI_QDRYHIDQSA_N_000_000000

PubChem Compound ID:

70678955