EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:157043 - N-[(2S,3R,4R,5R,6R)-2,5-Dihydroxy-6-(hydroxymethyl)-4-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide

Default Structure
ChEBI IDCHEBI:157043
ChEBI NameN-[(2S,3R,4R,5R,6R)-2,5-Dihydroxy-6-(hydroxymethyl)-4-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC14H25NO11
Net Charge0
Average Mass383.350
Monoisotopic Mass383.14276
SMILESCC(=O)N[C@@H]1[C@@H](OC2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H](CO)O[C@@H]1O
WURCSWURCS=2.0/2,2,1/[a2112h-1a_1-5_2*NCC/3=O][a2112h-1x_1-5]/1-2/a3-b1
InChIInChI=1S/C14H25NO11/c1-4(18)15-7-12(9(20)6(3-17)24-13(7)23)26-14-11(22)10(21)8(19)5(2-16)25-14/h5-14,16-17,19-23H,2-3H2,1H3,(H,15,18)/t5-,6-,7-,8+,9+,10+,11-,12-,13+,14?/m1/s1
InChIKeyHMQPEDMEOBLSQB-PDRYYTORSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3R,4R,5R,6R)-2,5-Dihydroxy-6-(hydroxymethyl)-4-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide (CHEBI:157043) is a carbohydrates and carbohydrate derivatives (CHEBI:78616)
Synonyms  Source
D-galacto-hexopyranosyl-(1->3)-2-acetamido-2-deoxy-alpha-D-galacto-hexopyranoseSUBMITTER
Gal(?1-3)a-GalNAcSUBMITTER
Manual XrefsDatabases
G54499HRGlyGen
G54499HRGlyTouCan