CHEBI:145984 - methyl 8-{[N-acetyl-α-neuraminosyl-(2→3)-β-D-galactosyl-(1→3)-N-acetyl-β-D-glucosaminyl]oxy}nonanoate(1−)

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ChEBI Name methyl 8-{[N-acetyl-α-neuraminosyl-(2→3)-β-D-galactosyl-(1→3)-N-acetyl-β-D-glucosaminyl]oxy}nonanoate(1−)
ChEBI ID CHEBI:145984
ChEBI ASCII Name methyl 8-{[N-acetyl-alpha-neuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl]oxy}nonanoate(1-)
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information We are unable to retrieve the vendor information for this entry at this time. Please try again later.
Download Molfile XML SDF
Formula C35H59N2O21
Net Charge -1
Average Mass 843.851
Monoisotopic Mass 843.36158
InChI InChI=1S/C35H60N2O21/c1-16(41)36-23-18(43)12-35(34(50)51,57-30(23)25(46)19(44)13-38)58-31-27(48)21(15-40)55-33(28(31)49)56-29-24(37-17(2)42)32(54-20(14-39)26(29)47)53-11-9-7-5-4-6-8-10-22(45)52-3/h18-21,23-33,38-40,43-44,46-49H,4-15H2,1-3H3,(H,36,41)(H,37,42)(H,50,51)/p-1/t18-,19+,20+,21+,23+,24+,25+,26+,27-,28+,29+,30+,31-,32+,33-,35-/m0/s1
InChIKey SHEDRPLGXZDJOE-VIXPEKPXSA-M
SMILES O([C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O[C@]3(O[C@@]([C@@H]([C@H](C3)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)-N-acetyl-β-D-glucosaminyl]oxy}nonanoate(1−) (CHEBI:145984) is a N-acetyl-α-neuraminyl-(2→3)-β-D-galactosyl-(1→3)-N-acetyl-β-D-galactosaminide(1−) (CHEBI:136589)
methyl 8-{[N-acetyl-α-neuraminosyl-(2→3)-β-D-galactosyl-(1→3)-N-acetyl-β-D-glucosaminyl]oxy}nonanoate(1−) (CHEBI:145984) is a glucosamine oligosaccharide (CHEBI:22485)
Synonym Source
methyl 8-{[N-acetyl-α-neuraminosyl-(2→3)-β-D-galactosyl-(1→3)-N-acetyl-β-D-glucosaminyl]oxy}nonanoate UniProt
Citation Waiting for Citations Type Source
7721776 PubMed citation SUBMITTER