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CHEBI:155479 - N-[(2R,3R,4R,5R,6R)-2-[(2R,3S,4S,5R,6R)-3,5-Dihydroxy-2-(hydroxymethyl)-6-[(3S,4R,5S,6S)-2,4,5-trihydroxy-6-methyloxan-3-yl]oxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide

ChEBI IDCHEBI:155479
ChEBI NameN-[(2R,3R,4R,5R,6R)-2-[(2R,3S,4S,5R,6R)-3,5-Dihydroxy-2-(hydroxymethyl)-6-[(3S,4R,5S,6S)-2,4,5-trihydroxy-6-methyloxan-3-yl]oxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC20H35NO15
Net Charge0
Average Mass529.492
Monoisotopic Mass529.20067
SMILESCC(=O)N[C@H]1[C@@H](O[C@H]2[C@@H](O)[C@@H](CO)O[C@H](O[C@@H]3C(O)O[C@@H](C)[C@@H](O)[C@H]3O)[C@@H]2O)O[C@H](CO)[C@H](O)[C@@H]1O
WURCSWURCS=2.0/3,3,2/[a1221m-1x_1-5][a2112h-1a_1-5][a2112h-1a_1-5_2*NCC/3=O]/1-2-3/a2-b1_b3-c1
InChIInChI=1S/C20H35NO15/c1-5-10(25)14(29)17(18(31)32-5)36-20-15(30)16(12(27)8(4-23)34-20)35-19-9(21-6(2)24)13(28)11(26)7(3-22)33-19/h5,7-20,22-23,25-31H,3-4H2,1-2H3,(H,21,24)/t5-,7+,8+,9+,10+,11-,12-,13+,14+,15+,16-,17-,18?,19+,20+/m0/s1
InChIKeyLWWOWUTYCKFOOE-DHCWZOEVSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3R,4R,5R,6R)-2-[(2R,3S,4S,5R,6R)-3,5-Dihydroxy-2-(hydroxymethyl)-6-[(3S,4R,5S,6S)-2,4,5-trihydroxy-6-methyloxan-3-yl]oxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide (CHEBI:155479) is a oligosaccharide (CHEBI:50699)
Synonyms  Source
GalNAc(a1-3)Gal(a1-2)FucSUBMITTER
2-acetamido-2-deoxy-alpha-D-galacto-hexopyranosyl-(1->3)-alpha-D-galacto-hexopyranosyl-(1->2)-6-deoxy-L-galacto-hexopyranoseSUBMITTER
Manual XrefsDatabases
G92996ITGlyTouCan
G92996ITGlyGen