EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:155263 - (2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-Dihydroxy-2-(hydroxymethyl)-6-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-2-yl]methoxy]oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

ChEBI IDCHEBI:155263
ChEBI Name(2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-Dihydroxy-2-(hydroxymethyl)-6-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-2-yl]methoxy]oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC24H42O21
Net Charge0
Average Mass666.579
Monoisotopic Mass666.22186
SMILESOC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@H](O[C@H]4[C@H](O)[C@@H](O)C(O)O[C@@H]4CO)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O
WURCSWURCS=2.0/3,4,3/[a2122h-1x_1-5][a2122h-1a_1-5][a2122h-1b_1-5]/1-2-3-2/a4-b1_b6-c1_c4-d1
InChIInChI=1S/C24H42O21/c25-1-5-9(28)11(30)16(35)23(41-5)45-20-7(3-27)42-22(18(37)14(20)33)39-4-8-10(29)12(31)17(36)24(43-8)44-19-6(2-26)40-21(38)15(34)13(19)32/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
InChIKeyKLXDQPPPPSDDBD-YVUQSTLQSA-N
ChEBI Ontology
Outgoing Relation(s)
(2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-Dihydroxy-2-(hydroxymethyl)-6-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-2-yl]methoxy]oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol (CHEBI:155263) is a oligosaccharide (CHEBI:50699)
Synonyms  Source
Glc(a1-4)Glc(b1-6)Glc(a1-4)GlcSUBMITTER
alpha-D-gluco-hexopyranosyl-(1->4)-beta-D-gluco-hexopyranosyl-(1->6)-alpha-D-gluco-hexopyranosyl-(1->4)-D-gluco-hexopyranoseSUBMITTER
Manual XrefsDatabases
G92047WHGlyTouCan
G92047WHGlyGen