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CHEBI:153057 - N-[(3R,4R,5S,6R)-4-Hydroxy-6-(hydroxymethyl)-2-[(3S,4S,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-5-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide

ChEBI IDCHEBI:153057
ChEBI NameN-[(3R,4R,5S,6R)-4-Hydroxy-6-(hydroxymethyl)-2-[(3S,4S,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-5-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC20H35NO16
Net Charge0
Average Mass545.491
Monoisotopic Mass545.19558
SMILESCC(=O)N[C@H]1C(O[C@@H]2C(O)O[C@H](CO)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](OC2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O
WURCSWURCS=2.0/3,3,2/[a1122h-1x_1-5][a2122h-1x_1-5_2*NCC/3=O][a2112h-1x_1-5]/1-2-3/a2-b1_b4-c1
InChIInChI=1S/C20H35NO16/c1-5(25)21-9-12(28)16(36-20-15(31)13(29)10(26)7(3-23)34-20)8(4-24)35-19(9)37-17-14(30)11(27)6(2-22)33-18(17)32/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
InChIKeyREVOVWCTUZRTEK-MHBVOWLWSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(3R,4R,5S,6R)-4-Hydroxy-6-(hydroxymethyl)-2-[(3S,4S,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-5-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide (CHEBI:153057) is a oligosaccharide (CHEBI:50699)
Synonyms  Source
Gal(?1-4)GlcNAc(?1-2)ManSUBMITTER
D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-D-gluco-hexopyranosyl-(1->2)-D-manno-hexopyranoseSUBMITTER
Manual XrefsDatabases
G68153EGGlyTouCan
G68153EGGlyGen