CHEBI:146455 - β-D-GlcpNAc-(1→4)-[α-D-Manp-(1→3)]-D-Manp

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name β-D-GlcpNAc-(1→4)-[α-D-Manp-(1→3)]-D-Manp
ChEBI ID CHEBI:146455
ChEBI ASCII Name beta-D-GlcpNAc-(1->4)-[alpha-D-Manp-(1->3)]-D-Manp
Definition An amino trisaccharide consisting of D-mannopyranose in which the hydroxy groups at positions 3 and 4 have been converted into the corresponding α-D-mannopyranosyl and 2-acetamino-2-deoxy-β-D-glucopyranosyl derivatives, respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Gareth Owen
Supplier Information
Download Molfile XML SDF
more structures >>
Formula C20H35NO16
Net Charge 0
Average Mass 545.491
Monoisotopic Mass 545.19558
InChI InChI=1S/C20H35NO16/c1-5(25)21-9-12(28)10(26)6(2-22)34-19(9)36-16-8(4-24)33-18(32)15(31)17(16)37-20-14(30)13(29)11(27)7(3-23)35-20/h6-20,22-24,26-32H,2-4H2,1H3,(H,21,25)/t6-,7-,8-,9-,10-,11-,12-,13+,14+,15+,16-,17-,18?,19+,20-/m1/s1
InChIKey BUYVRRRTUWOEBL-HYHMQFQTSA-N
SMILES O([C@H]1[C@H](O[C@H]2O[C@@H]([C@@H](O)[C@H](O)[C@@H]2O)CO)[C@H](O)C(O[C@@H]1CO)O)[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3NC(=O)C)CO
ChEBI Ontology
Outgoing β-D-GlcpNAc-(1→4)-[α-D-Manp-(1→3)]-D-Manp (CHEBI:146455) has functional parent α-D-Manp-(1→3)-D-Manp (CHEBI:53451)
β-D-GlcpNAc-(1→4)-[α-D-Manp-(1→3)]-D-Manp (CHEBI:146455) has functional parent β-D-GlcpNAc-(1→4)-D-Manp (CHEBI:147602)
β-D-GlcpNAc-(1→4)-[α-D-Manp-(1→3)]-D-Manp (CHEBI:146455) is a acetamides (CHEBI:22160)
β-D-GlcpNAc-(1→4)-[α-D-Manp-(1→3)]-D-Manp (CHEBI:146455) is a amino trisaccharide (CHEBI:59266)
IUPAC Names
2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→4)-[α-D-mannopyranosyl-(1→3)]-D-mannopyranose
Man(a1-3)[GlcNAc(b1-4)]Man
Synonyms Sources
α-D-manno-hexopyranosyl-(1→3)-[2-acetamido-2-deoxy-β-D-gluco-hexopyranosyl-(1→4)]-D-manno-hexopyranose IUPAC
N-[(2S,3R,4R,5S,6R)-2-[(2R,3R,4R,5S)-5,6-dihydroxy-2-(hydroxymethyl)-4-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide IUPAC
WURCS=2.0/3,3,2/[a1122h-1x_1-5][a1122h-1a_1-5][a2122h-1b_1-5_2*NCC/3=O]/1-2-3/a3-b1_a4-c1 SUBMITTER
Manual Xrefs Databases
G01141WK GlyTouCan
G01141WK GlyGen
G03540 KEGG GLYCAN
View more database links
Last Modified
18 May 2020