CHEBI:145985 - methyl 8-{[N-acetyl-α-neuraminosyl-(2→3)-β-D-galactosyl-(1→3)-[α-L-fucosyl-(1→4)]-N-acetyl-β-D-glucosaminyl]oxy}nonanoate(1−)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name methyl 8-{[N-acetyl-α-neuraminosyl-(2→3)-β-D-galactosyl-(1→3)-[α-L-fucosyl-(1→4)]-N-acetyl-β-D-glucosaminyl]oxy}nonanoate(1−)
ChEBI ID CHEBI:145985
ChEBI ASCII Name methyl 8-{[N-acetyl-alpha-neuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->4)]-N-acetyl-beta-D-glucosaminyl]oxy}nonanoate(1-)
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C41H69N2O25
Net Charge -1
Average Mass 989.993
Monoisotopic Mass 989.41949
InChI InChI=1S/C41H70N2O25/c1-17-27(52)30(55)31(56)38(62-17)65-33-23(16-46)64-37(61-12-10-8-6-5-7-9-11-24(51)60-4)26(43-19(3)48)35(33)66-39-32(57)36(29(54)22(15-45)63-39)68-41(40(58)59)13-20(49)25(42-18(2)47)34(67-41)28(53)21(50)14-44/h17,20-23,25-39,44-46,49-50,52-57H,5-16H2,1-4H3,(H,42,47)(H,43,48)(H,58,59)/p-1/t17-,20-,21+,22+,23+,25+,26+,27+,28+,29-,30+,31-,32+,33+,34+,35+,36-,37+,38-,39-,41-/m0/s1
InChIKey MRVHODPGJNSPTI-KYXCDNDQSA-M
SMILES O([C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@@H]2O[C@H]([C@H]([C@H]([C@@H]2O)O)O)C)O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O[C@]4(O[C@@]([C@@H]([C@H](C4)O)NC(C)=O)([H])[C@@H]([C@@H](CO)O)O)C([O-])=O)O)NC(=O)C)CCCCCCCCC(OC)=O
ChEBI Ontology
Outgoing methyl 8-{[N-acetyl-α-neuraminosyl-(2→3)-β-D-galactosyl-(1→3)-[α-L-fucosyl-(1→4)]-N-acetyl-β-D-glucosaminyl]oxy}nonanoate(1−) (CHEBI:145985) is a glucosamine oligosaccharide (CHEBI:22485)
Synonym Source
methyl 8-{[N-acetyl-α-neuraminosyl-(2→3)-β-D-galactosyl-(1→3)-[α-L-fucosyl-(1→4)]-N-acetyl-β-D-glucosaminyl]oxy}nonanoate UniProt
Citation Waiting for Citations Type Source
7721776 PubMed citation SUBMITTER