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CHEBI:77382 - β-D-Glcp-(1→4)-[α-D-GlcpNAc-(1→2)-L-α-D-Hepp-(1→3)]-L-α-D-Hepp-(1→5)-Kdo

ChEBI IDCHEBI:77382
ChEBI Nameβ-D-Glcp-(1→4)-[α-D-GlcpNAc-(1→2)-L-α-D-Hepp-(1→3)]-L-α-D-Hepp-(1→5)-Kdo
Stars
ASCII Namebeta-D-Glcp-(1->4)-[alpha-D-GlcpNAc-(1->2)-L-alpha-D-Hepp-(1->3)]-L-alpha-D-Hepp-(1->5)-Kdo
DefinitionA branched amino pentasaccharide consisting of a trisaccharide chain of β-D-glucose, L-glycero-α-D-manno-heptose (Hep) and 3-deoxy-D-manno-oct-2-ulose (Kdo) residues linked in a (1→4), (1→5) sequence, to the Hep residue of which is linked (1→3) an N-acetyl-α-D-glucosaminyl-(1→2)-L-glycero-α-D-manno-heptosyl side-chain. lpt3 and and galE mutant of the core oligosaccharide of Neisseria meningitidis.
Last Modified19 February 2014
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC36H61NO30
Net Charge0
Average Mass987.861
Monoisotopic Mass987.32784
SMILES[H][C@]1([C@H](O)CO)OC(O)(C(=O)O)C[C@@H](O)[C@H]1O[C@H]1O[C@]([H])([C@@H](O)CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O[C@H]2O[C@]([H])([C@@H](O)CO)[C@@H](O)[C@H](O)[C@@H]2O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)[C@@H]1O
InChIInChI=1S/C36H61NO30/c1-8(43)37-15-18(50)16(48)13(6-41)59-31(15)65-29-21(53)20(52)24(10(45)3-38)61-34(29)64-28-23(55)33(62-25-9(44)2-36(58,35(56)57)67-27(25)12(47)5-40)63-26(11(46)4-39)30(28)66-32-22(54)19(51)17(49)14(7-42)60-32/h9-34,38-42,44-55,58H,2-7H2,1H3,(H,37,43)(H,56,57)/t9-,10+,11+,12-,13-,14-,15-,16-,17-,18-,19+,20+,21+,22-,23+,24-,25-,26-,27-,28-,29+,30-,31-,32+,33+,34-,36?/m1/s1
InChIKeyNKNWYGUTMQXMGK-MMPXUFKBSA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-Glcp-(1→4)-[α-D-GlcpNAc-(1→2)-L-α-D-Hepp-(1→3)]-L-α-D-Hepp-(1→5)-Kdo (CHEBI:77382) is a amino pentasaccharide (CHEBI:59268)
IUPAC Names 
2-acetamido-2-deoxy-α-D-glucopyranosyl-(1→2)-(5R)-5-[(1S)-1,2-dihydroxyethyl]-α-D-lyxopyranosyl-(1→3)-[β-D-glucopyranosyl-(1→4)]-(5R)-5-[(1S)-1,2-dihydroxyethyl]-α-D-lyxopyranosyl-(1→5)-(6R)-3-deoxy-6-[(1R)-1,2-dihydroxyethyl]-L-erythro-hex-2-ulopyranosonic acid
2-acetamido-2-deoxy-α-D-glucopyranosyl-(1→2)-L-glycero-α-D-manno-heptopyranosyl-(1→3)-[β-D-glucopyranosyl-(1→4)]-L-glycero-α-D-manno-heptopyranosyl-(1→5)-3-deoxy-D-manno-oct-2-ulopyranosonic acid
Synonyms  Source
N-acetyl-α-D-glucosaminyl-(1→2)-L-glycero-α-D-manno-heptosyl-(1→3)-[β-D-glucosyl-(1→4)]-L-glycero-α-D-manno-heptosyl-(1→5)-3-deoxy-D-manno-oct-2-ulosonic acidChEBI
β-D-Glc-(1→4)-[α-D-GlcNAc-(1→2)-3-PEA-L-α-D-Hep-(1→3)]-L-α-D-Hep-(1→5)-Kdo [Click on the icon to display the ASCII name]ChEBI
Citations