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CHEBI:50675 - β-D-glucosaminyl-(1→4)-D-glucosamine

Default Structure
ChEBI IDCHEBI:50675
ChEBI Nameβ-D-glucosaminyl-(1→4)-D-glucosamine
Stars
ASCII Namebeta-D-glucosaminyl-(1->4)-D-glucosamine
Last Modified7 April 2021
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC12H24N2O9
Net Charge0
Average Mass340.329
Monoisotopic Mass340.14818
SMILESN[C@H]1[C@H](O[C@H]2[C@H](O)[C@@H](N)C(O)O[C@@H]2CO)O[C@H](CO)[C@@H](O)[C@@H]1O
WURCSWURCS=2.0/2,2,1/[a2122h-1x_1-5_2*N][a2122h-1b_1-5_2*N]/1-2/a4-b1
InChIInChI=1S/C12H24N2O9/c13-5-9(19)10(4(2-16)21-11(5)20)23-12-6(14)8(18)7(17)3(1-15)22-12/h3-12,15-20H,1-2,13-14H2/t3-,4-,5-,6-,7-,8-,9-,10-,11?,12+/m1/s1
InChIKeyQLTSDROPCWIKKY-ZMYKSUFESA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-glucosaminyl-(1→4)-D-glucosamine (CHEBI:50675) is a chitobioses (CHEBI:50674)
Incoming Relation(s)
N-acetyl-β-D-glucosaminyl-(1→4)-D-glucosamine (CHEBI:59922) has functional parent β-D-glucosaminyl-(1→4)-D-glucosamine (CHEBI:50675)
N,N'-diacetylchitobiose (CHEBI:28681) has functional parent β-D-glucosaminyl-(1→4)-D-glucosamine (CHEBI:50675)
N'-monoacetylchitobiose-6'-phosphate (CHEBI:71317) has functional parent β-D-glucosaminyl-(1→4)-D-glucosamine (CHEBI:50675)
diacetylchitobiose-6'-phosphate (CHEBI:64897) has functional parent β-D-glucosaminyl-(1→4)-D-glucosamine (CHEBI:50675)
β-D-glucosaminyl-(1→4)-α-D-glucosamine (CHEBI:50676) is a β-D-glucosaminyl-(1→4)-D-glucosamine (CHEBI:50675)
β-D-glucosaminyl-(1→4)-β-D-glucosamine (CHEBI:50677) is a β-D-glucosaminyl-(1→4)-D-glucosamine (CHEBI:50675)
IUPAC Name 
2-amino-4-O-(2-amino-2-deoxy-β-D-glucopyranosyl)-2-deoxy-D-glucopyranose
Manual XrefsDatabases
G83234UJGlyGen
G83234UJGlyTouCan
Registry NumbersSources
Beilstein:1654149Beilstein