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CHEBI:150882 - N-[(2R,3R,4R,5S,6R)-2-[(2S,3R,4S,5S)-5-[(1R)-1,2-Dihydroxyethyl]-4-hydroxy-2-[(2S,3S,4S,5R)-1,3,4,5,6-pentahydroxyhexan-2-yl]oxyoxolan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide

ChEBI IDCHEBI:150882
ChEBI NameN-[(2R,3R,4R,5S,6R)-2-[(2S,3R,4S,5S)-5-[(1R)-1,2-Dihydroxyethyl]-4-hydroxy-2-[(2S,3S,4S,5R)-1,3,4,5,6-pentahydroxyhexan-2-yl]oxyoxolan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC20H37NO16
Net Charge0
Average Mass547.507
Monoisotopic Mass547.21123
SMILESCC(=O)N[C@H]1[C@@H](O[C@H]2[C@@H](O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H](O)CO)O[C@@H]([C@H](O)CO)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O
WURCSWURCS=2.0/3,3,2/[h2112h][a2112h-1a_1-4][a2122h-1a_1-5_2*NCC/3=O]/1-2-3/a2-b1_b2-c1
InChIInChI=1S/C20H37NO16/c1-6(26)21-11-15(32)14(31)10(5-25)34-19(11)37-18-16(33)17(8(28)3-23)36-20(18)35-9(4-24)13(30)12(29)7(27)2-22/h7-20,22-25,27-33H,2-5H2,1H3,(H,21,26)/t7-,8-,9+,10-,11-,12+,13-,14-,15-,16+,17+,18-,19-,20+/m1/s1
InChIKeyFBEKMEQAXBNUDD-XVPCBRDSSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3R,4R,5S,6R)-2-[(2S,3R,4S,5S)-5-[(1R)-1,2-Dihydroxyethyl]-4-hydroxy-2-[(2S,3S,4S,5R)-1,3,4,5,6-pentahydroxyhexan-2-yl]oxyoxolan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide (CHEBI:150882) is a oligosaccharide (CHEBI:50699)
Manual XrefsDatabases
G44008CQGlyTouCan
G44008CQGlyGen