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CHEBI:157562 - N-[(2R,3R,4R,5S,6R)-2-Hydroxy-6-(hydroxymethyl)-4,5-bis[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-3-yl]acetamide

Default Structure
ChEBI IDCHEBI:157562
ChEBI NameN-[(2R,3R,4R,5S,6R)-2-Hydroxy-6-(hydroxymethyl)-4,5-bis[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-3-yl]acetamide
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC20H35NO16
Net Charge0
Average Mass545.491
Monoisotopic Mass545.19558
SMILESCC(=O)N[C@@H]1[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](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](CO)O[C@H]1O
WURCSWURCS=2.0/2,3,2/[a2122h-1b_1-5_2*NCC/3=O][a1122h-1a_1-5]/1-2-2/a3-b1_a4-c1
InChIInChI=1S/C20H35NO16/c1-5(25)21-9-17(37-20-15(31)13(29)11(27)7(3-23)35-20)16(8(4-24)33-18(9)32)36-19-14(30)12(28)10(26)6(2-22)34-19/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
InChIKeyLYDZFUBFIMTEOS-FKIXRAPISA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3R,4R,5S,6R)-2-Hydroxy-6-(hydroxymethyl)-4,5-bis[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-3-yl]acetamide (CHEBI:157562) is a carbohydrates and carbohydrate derivatives (CHEBI:78616)
Synonyms  Source
alpha-D-manno-hexopyranosyl-(1->3)-[alpha-D-manno-hexopyranosyl-(1->4)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranoseSUBMITTER
Man(a1-3)[Man(a1-4)]b-GlcNAcSUBMITTER
Manual XrefsDatabases
G17750OEGlyTouCan
G17750OEGlyGen