EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:146771 - (3R,4S,5S,6R)-6-[[(2S,3R,4R,5S,6R)-3,4-Dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxymethyl]oxane-2,3,4,5-tetrol

ChEBI IDCHEBI:146771
ChEBI Name(3R,4S,5S,6R)-6-[[(2S,3R,4R,5S,6R)-3,4-Dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxymethyl]oxane-2,3,4,5-tetrol
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC24H42O21
Net Charge0
Average Mass666.579
Monoisotopic Mass666.22186
SMILESOC[C@H]1O[C@H](OC[C@H]2O[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@@H](OC[C@H]4OC(O)[C@H](O)[C@@H](O)[C@@H]4O)O[C@@H]3CO)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
WURCSWURCS=2.0/2,4,3/[a2122h-1x_1-5][a2122h-1a_1-5]/1-2-2-2/a6-b1_b4-c1_c6-d1
InChIInChI=1S/C24H42O21/c25-1-5-9(27)13(31)17(35)22(42-5)40-4-8-11(29)14(32)18(36)24(44-8)45-20-6(2-26)43-23(19(37)15(20)33)39-3-7-10(28)12(30)16(34)21(38)41-7/h5-38H,1-4H2/t5-,6-,7-,8-,9-,10-,11-,12+,13+,14+,15-,16-,17-,18-,19-,20-,21?,22+,23+,24-/m1/s1
InChIKeyMSIUMWYJZAFPIF-WNPOOKDXSA-N
ChEBI Ontology
Outgoing Relation(s)
(3R,4S,5S,6R)-6-[[(2S,3R,4R,5S,6R)-3,4-Dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxymethyl]oxane-2,3,4,5-tetrol (CHEBI:146771) is a oligosaccharide (CHEBI:50699)
Synonyms  Source
Glc(a1-6)Glc(a1-4)Glc(a1-6)GlcSUBMITTER
alpha-D-gluco-hexopyranosyl-(1->6)-alpha-D-gluco-hexopyranosyl-(1->4)-alpha-D-gluco-hexopyranosyl-(1->6)-D-gluco-hexopyranoseSUBMITTER
Manual XrefsDatabases
G05153MOGlyTouCan
G05153MOGlyGen