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CHEBI:156602 - N-[(3R,4R,5S,6R)-4-[(2S,3S,4S,5S,6S)-3,4-Dihydroxy-6-methyl-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide

Default Structure
ChEBI IDCHEBI:156602
ChEBI NameN-[(3R,4R,5S,6R)-4-[(2S,3S,4S,5S,6S)-3,4-Dihydroxy-6-methyl-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2,5-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]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O[C@@H]1O[C@@H](C)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O
WURCSWURCS=2.0/3,3,2/[a2122h-1x_1-5_2*NCC/3=O][a1221m-1a_1-5][a2112h-1b_1-5]/1-2-3/a3-b1_b4-c1
InChIInChI=1S/C20H35NO15/c1-5-16(35-20-14(29)12(27)10(25)7(3-22)34-20)13(28)15(30)19(32-5)36-17-9(21-6(2)24)18(31)33-8(4-23)11(17)26/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
InChIKeyFGXHZZJAOOBUJZ-GQFCPDRMSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(3R,4R,5S,6R)-4-[(2S,3S,4S,5S,6S)-3,4-Dihydroxy-6-methyl-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide (CHEBI:156602) is a carbohydrates and carbohydrate derivatives (CHEBI:78616)
Synonyms  Source
beta-D-galacto-hexopyranosyl-(1->4)-6-deoxy-alpha-L-galacto-hexopyranosyl-(1->3)-2-acetamido-2-deoxy-D-gluco-hexopyranoseSUBMITTER
Gal(b1-4)Fuc(a1-3)GlcNAcSUBMITTER
Manual XrefsDatabases
G68084OMGlyGen
G68084OMGlyTouCan