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CHEBI:146019 - α-D-Man-(1→2)-α-D-Man-(1→6)-α-D-Man-(1→4)-β-D-GlcN-O[CH2]6SH

ChEBI IDCHEBI:146019
ChEBI Nameα-D-Man-(1→2)-α-D-Man-(1→6)-α-D-Man-(1→4)-β-D-GlcN-O[CH2]6SH
Stars
ASCII Namealpha-D-Man-(1->2)-alpha-D-Man-(1->6)-alpha-D-Man-(1->4)-beta-D-GlcN-O[CH2]6SH
DefinitionA linear tetrasaccharide derivative consisting of three α-D-mannose residues and one β-D-glucosamine residue, linked sequentially (1→2), (1→6) and (1→4), with the glucosamine residue linked glycosidically to a 6-sulfanylhexyl group.
Last Modified12 February 2020
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC30H55NO20S
Net Charge0
Average Mass781.824
Monoisotopic Mass781.30381
SMILESN[C@H]1[C@H](OCCCCCCS)O[C@H](CO)[C@@H](O[C@H]2O[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](O)[C@@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H]1O
InChIInChI=1S/C30H55NO20S/c31-15-19(38)25(13(9-34)48-27(15)44-5-3-1-2-4-6-52)50-29-24(43)21(40)18(37)14(49-29)10-45-30-26(22(41)17(36)12(8-33)47-30)51-28-23(42)20(39)16(35)11(7-32)46-28/h11-30,32-43,52H,1-10,31H2/t11-,12-,13-,14-,15-,16-,17-,18-,19-,20+,21+,22+,23+,24+,25-,26+,27-,28-,29-,30+/m1/s1
InChIKeyQEXSAWLGDLSFSM-AIQHVDQGSA-N
ChEBI Ontology
Outgoing Relation(s)
α-D-Man-(1→2)-α-D-Man-(1→6)-α-D-Man-(1→4)-β-D-GlcN-O[CH2]6SH (CHEBI:146019) is a glycoside (CHEBI:24400)
α-D-Man-(1→2)-α-D-Man-(1→6)-α-D-Man-(1→4)-β-D-GlcN-O[CH2]6SH (CHEBI:146019) is a tetrasaccharide derivative (CHEBI:63567)
IUPAC Name 
6-sulfanylhexyl α-D-mannopyranosyl-(1→2)-α-D-mannopyranosyl-(1→6)-α-D-mannopyranosyl-(1→4)-2-amino-2-deoxy-β-D-glucopyranoside
Synonyms  Source
6-mercaptohexyl α-D-mannosyl-(1→2)-α-D-mannosyl-(1→6)-α-D-mannosyl-(1→4)-β-D-glucosaminideChEBI
1-O-(6-thio)hexyl α-D-mannopyranosyl-(1→2)-α-D-mannopyranosyl-(1→6)-α-D-mannopyranosyl-(1→4)-2-amino-2-deoxy β-D-glucopyranosideChEBI
α-D-Manp-(1→2)-α-D-Manp-(1→6)-α-D-Manp-(1→4)-β-D-GlcpN-O[CH2]6SHIUPAC
Citations