CHEBI:153831 - N-[(2R,3R,4R,5S,6R)-2,4-Dihydroxy-5-[(2S,3R,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-6-(hydroxymethyl)oxan-3-yl]acetamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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ChEBI Name N-[(2R,3R,4R,5S,6R)-2,4-Dihydroxy-5-[(2S,3R,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-6-(hydroxymethyl)oxan-3-yl]acetamide
ChEBI ID CHEBI:153831
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/c1-6-13(26)15(28)16(29)20(31-6)33-9-3-8(25)10(4-22)34-19(9)35-17-11(5-23)32-18(30)12(14(17)27)21-7(2)24/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 CCOGAJRIGKEXJI-SUBXTBOHSA-N
SMILES O([C@H]1[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]1CO)O)[C@@H]2O[C@@H]([C@H](O)C[C@H]2O[C@@H]3O[C@H]([C@@H](O)[C@@H](O)[C@@H]3O)C)CO
ChEBI Ontology
Outgoing N-[(2R,3R,4R,5S,6R)-2,4-Dihydroxy-5-[(2S,3R,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-6-(hydroxymethyl)oxan-3-yl]acetamide (CHEBI:153831) is a amino sugar (CHEBI:28963)
Synonyms Sources
6-deoxy-alpha-L-galacto-hexopyranosyl-(1->2)-3-deoxy-beta-D-xylo-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranose SUBMITTER
Fuc(a1-2)3-deoxy-D-xylHex(b1-4)b-GlcNAc SUBMITTER
WURCS=2.0/3,3,2/[a2122h-1b_1-5_2*NCC/3=O][a2d12h-1b_1-5][a1221m-1a_1-5]/1-2-3/a4-b1_b2-c1 SUBMITTER
Manual Xrefs Databases
G80530IL GlyTouCan
G80530IL GlyGen
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