CHEBI:154662 - N-[(2R,3R,4R,5S,6R)-5-[(2S,3S,5S,6S)-3,5-Dihydroxy-6-methyloxan-2-yl]oxy-2-hydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide

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ChEBI Name N-[(2R,3R,4R,5S,6R)-5-[(2S,3S,5S,6S)-3,5-Dihydroxy-6-methyloxan-2-yl]oxy-2-hydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide
ChEBI ID CHEBI:154662
Stars This entity has been manually annotated by a third party.
Submitter Gareth Owen
Supplier Information
Download Molfile XML SDF
Formula C20H35NO14
Net Charge 0
Average Mass 513.493
Monoisotopic Mass 513.20575
InChI InChI=1S/C20H35NO14/c1-6-8(25)3-9(26)19(31-6)34-16-11(5-23)32-18(30)12(21-7(2)24)17(16)35-20-15(29)14(28)13(27)10(4-22)33-20/h6,8-20,22-23,25-30H,3-5H2,1-2H3,(H,21,24)/t6-,8-,9-,10+,11+,12+,13-,14-,15+,16+,17+,18+,19-,20-/m0/s1
InChIKey BUKQTTMTAOLTDQ-OGGFWIATSA-N
SMILES O([C@H]1[C@H](O[C@@H]2O[C@H]([C@@H](O)C[C@@H]2O)C)[C@H](O[C@@H](O)[C@@H]1NC(=O)C)CO)[C@@H]3O[C@@H]([C@H](O)[C@H](O)[C@H]3O)CO
ChEBI Ontology
Outgoing N-[(2R,3R,4R,5S,6R)-5-[(2S,3S,5S,6S)-3,5-Dihydroxy-6-methyloxan-2-yl]oxy-2-hydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide (CHEBI:154662) is a amino sugar (CHEBI:28963)
Synonyms Sources
beta-D-galacto-hexopyranosyl-(1->3)-[3,6-dideoxy-alpha-L-xylo-hexopyranosyl-(1->4)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranose SUBMITTER
Gal(b1-3)[Col(a1-4)]b-GlcNAc SUBMITTER
WURCS=2.0/3,3,2/[a2122h-1b_1-5_2*NCC/3=O][a2112h-1b_1-5][a1d21m-1a_1-5]/1-2-3/a3-b1_a4-c1 SUBMITTER
Manual Xrefs Databases
G89640BO GlyGen
G89640BO GlyTouCan
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