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CHEBI:77448 - β-D-QuipN4Fm-(1→4)-α-D-GalpNAcAN-(1→4)-α-D-GalpNAcAN-(1→3)-β-DQuipNAc

ChEBI IDCHEBI:77448
ChEBI Nameβ-D-QuipN4Fm-(1→4)-α-D-GalpNAcAN-(1→4)-α-D-GalpNAcAN-(1→3)-β-DQuipNAc
Stars
ASCII Namebeta-D-QuipN4Fm-(1->4)-alpha-D-GalpNAcAN-(1->4)-alpha-D-GalpNAcAN-(1->3)-beta-DQuipNAc
DefinitionAn amino tetrasaccharide comprising a 4-deoxy-4-formamido-β-D-quinovose residue, two 2-acetamido-2-deoxy-α-D-galacturonamide residues and an N-acetyl-β-D-quinovosamine residue linked in a (1→4), (1→4), (1→3) sequence.
Last Modified24 February 2014
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC31H50N6O19
Net Charge0
Average Mass810.764
Monoisotopic Mass810.31307
SMILES[H]C(=O)N[C@H]1[C@H](O)[C@@H](O)[C@H](O[C@@H]2[C@H](O)[C@@H](NC(C)=O)[C@@H](O[C@@H]3[C@H](O)[C@@H](NC(C)=O)[C@@H](O[C@H]4[C@H](O)[C@@H](C)O[C@@H](O)[C@@H]4NC(C)=O)O[C@@H]3C(N)=O)O[C@@H]2C(N)=O)O[C@@H]1C
InChIInChI=1S/C31H50N6O19/c1-7-12(34-6-38)17(43)20(46)31(51-7)54-23-19(45)14(36-10(4)40)30(56-25(23)27(33)48)53-22-18(44)13(35-9(3)39)29(55-24(22)26(32)47)52-21-15(37-11(5)41)28(49)50-8(2)16(21)42/h6-8,12-25,28-31,42-46,49H,1-5H3,(H2,32,47)(H2,33,48)(H,34,38)(H,35,39)(H,36,40)(H,37,41)/t7-,8-,12-,13-,14-,15-,16-,17+,18-,19-,20-,21-,22-,23-,24+,25+,28-,29+,30+,31+/m1/s1
InChIKeyWVMUWIIJOGRCBB-IBDLCBGPSA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-QuipN4Fm-(1→4)-α-D-GalpNAcAN-(1→4)-α-D-GalpNAcAN-(1→3)-β-DQuipNAc (CHEBI:77448) is a amino tetrasaccharide (CHEBI:59412)
IUPAC Names 
4-deoxy-4-formamido-β-D-quinovopyranosyl-(1→4)-2-acetamido-2-deoxy-α-D-galactopyranosyluronamide-(1→4)-2-acetamido-2-deoxy-α-D-galactopyranosyluronamide-(1→3)-2-acetamido-2-deoxy-β-D-quinovopyranose
4,6-dideoxy-4-formamido-β-D-glucopyranosyl-(1→4)-2-acetamido-2-deoxy-α-D-galactopyranosyluronamide-(1→4)-2-acetamido-2-deoxy-α-D-galactopyranosyluronamide-(1→3)-2-acetamido-2,6-dideoxy-β-D-glucopyranose
Synonyms  Source
β-D-QuiN4Fm-(1→4)-α-D-GalNAcAN-(1→4)-α-D-GalNAcAN-(1→3)-β-D-QuiNAcChEBI
4-deoxy-4-formamido-β-D-quinovosyl-(1→4)-2-acetamido-2-deoxy-α-D-galacturonamidyl-(1→4)-2-acetamido-2-deoxy-α-D-galacturonamidyl-(1→3)-N-acetyl-β-D-quinovosamineChEBI
Citations