CHEBI:154761 - N-[(2S,3R,4R,5S,6R)-5-[(2R,3S,4S,5R,6R)-4-[(2R,3S,4S,5R,6R)-4-[(2R,3S,4S,5R,6R)-4-[(2R,3R,4S,5S,6R)-4-[(2R,3R,4S,5S,6R)-3,5-Dihydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide

ChEBI IDCHEBI:154761
ChEBI NameN-[(2S,3R,4R,5S,6R)-5-[(2R,3S,4S,5R,6R)-4-[(2R,3S,4S,5R,6R)-4-[(2R,3S,4S,5R,6R)-4-[(2R,3R,4S,5S,6R)-4-[(2R,3R,4S,5S,6R)-3,5-Dihydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC44H75NO36
Net Charge0
Average Mass1194.055
Monoisotopic Mass1193.40688
SMILESCC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O[C@H]5O[C@H](CO)[C@H](O)[C@H](O[C@H]6O[C@H](CO)[C@H](O)[C@H](O[C@H]7O[C@H](CO)[C@H](O)[C@H](O)[C@H]7O)[C@H]6O)[C@H]5O)[C@@H]4O)[C@@H]3O)[C@@H]2O)[C@@H](CO)O[C@@H]1O
WURCSWURCS=2.0/3,7,6/[a2122h-1a_1-5_2*NCC/3=O][a1122h-1a_1-5][a2112h-1a_1-5]/1-2-2-2-3-3-3/a4-b1_b3-c1_c3-d1_d3-e1_e3-f1_f3-g1
InChIInChI=1S/C44H75NO36/c1-9(53)45-17-24(60)32(16(8-52)69-38(17)68)76-40-27(63)34(20(56)11(3-47)71-40)78-42-29(65)36(22(58)13(5-49)73-42)80-44-31(67)37(23(59)15(7-51)75-44)81-43-30(66)35(21(57)14(6-50)74-43)79-41-28(64)33(19(55)12(4-48)72-41)77-39-26(62)25(61)18(54)10(2-46)70-39/h10-44,46-52,54-68H,2-8H2,1H3,(H,45,53)/t10-,11-,12-,13-,14-,15-,16-,17-,18+,19+,20-,21+,22-,23-,24-,25+,26-,27+,28-,29+,30-,31+,32-,33+,34+,35+,36+,37+,38+,39-,40-,41-,42-,43-,44-/m1/s1
InChIKeyNGECVTYBJIAMJH-GJERUDJQSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3R,4R,5S,6R)-5-[(2R,3S,4S,5R,6R)-4-[(2R,3S,4S,5R,6R)-4-[(2R,3S,4S,5R,6R)-4-[(2R,3R,4S,5S,6R)-4-[(2R,3R,4S,5S,6R)-3,5-Dihydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide (CHEBI:154761) is a amino sugar (CHEBI:28963)
Synonyms  Source
alpha-D-galacto-hexopyranosyl-(1->3)-alpha-D-galacto-hexopyranosyl-(1->3)-alpha-D-galacto-hexopyranosyl-(1->3)-alpha-D-manno-hexopyranosyl-(1->3)-alpha-D-manno-hexopyranosyl-(1->3)-alpha-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-alpha-D-gluco-hexopyranoseSUBMITTER
Gal(a1-3)Gal(a1-3)Gal(a1-3)Man(a1-3)Man(a1-3)Man(a1-4)a-GlcNAcSUBMITTER
Manual XrefsDatabases
G87065VWGlyTouCan