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CHEBI:147635 - N-[(2S,3R,4S,5R)-4-[(2S,3S,4S,5S,6R)-6-[[(2S,3S,4S,5R,6R)-3,5-Dihydroxy-6-(hydroxymethyl)-4-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,5,6-tetrahydroxyhexan-2-yl]acetamide

ChEBI IDCHEBI:147635
ChEBI NameN-[(2S,3R,4S,5R)-4-[(2S,3S,4S,5S,6R)-6-[[(2S,3S,4S,5R,6R)-3,5-Dihydroxy-6-(hydroxymethyl)-4-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,5,6-tetrahydroxyhexan-2-yl]acetamide
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC26H47NO21
Net Charge0
Average Mass709.648
Monoisotopic Mass709.26406
SMILESCC(=O)N[C@@H](CO)[C@@H](O)[C@H](O[C@@H]1O[C@H](CO[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]3O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O)[C@H](O)CO
WURCSWURCS=2.0/3,4,3/[h2122h_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5]/1-2-3-3/a4-b1_b6-c1_c3-d1
InChIInChI=1S/C26H47NO21/c1-7(32)27-8(2-28)13(34)22(9(33)3-29)47-26-20(41)18(39)15(36)12(46-26)6-43-24-21(42)23(16(37)11(5-31)44-24)48-25-19(40)17(38)14(35)10(4-30)45-25/h8-26,28-31,33-42H,2-6H2,1H3,(H,27,32)/t8-,9+,10+,11+,12+,13+,14+,15+,16+,17-,18-,19-,20-,21-,22+,23-,24-,25+,26-/m0/s1
InChIKeyRTDVSFHMLPLLOO-HCWZXVIPSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3R,4S,5R)-4-[(2S,3S,4S,5S,6R)-6-[[(2S,3S,4S,5R,6R)-3,5-Dihydroxy-6-(hydroxymethyl)-4-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,5,6-tetrahydroxyhexan-2-yl]acetamide (CHEBI:147635) is a oligosaccharide (CHEBI:50699)
Manual XrefsDatabases
G11685NCGlyTouCan
G11685NCGlyGen