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CHEBI:148611 - (2S,3R,4R,5R)-4-[(2S,3R,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-3,5-Dihydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexane-1,2,3,5,6-pentol

ChEBI IDCHEBI:148611
ChEBI Name(2S,3R,4R,5R)-4-[(2S,3R,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-3,5-Dihydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexane-1,2,3,5,6-pentol
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC24H44O21
Net Charge0
Average Mass668.595
Monoisotopic Mass668.23751
SMILESOC[C@@H](O)[C@@H](O[C@@H]1O[C@H](CO)[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]3O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)[C@@H](O)CO
WURCSWURCS=2.0/3,4,3/[h2122h][a2122h-1b_1-5][a2112h-1b_1-5]/1-2-2-3/a4-b1_b4-c1_c3-d1
InChIInChI=1S/C24H44O21/c25-1-6(30)11(32)19(7(31)2-26)43-23-17(38)15(36)20(10(5-29)42-23)44-24-18(39)21(13(34)9(4-28)41-24)45-22-16(37)14(35)12(33)8(3-27)40-22/h6-39H,1-5H2/t6-,7+,8+,9+,10+,11+,12-,13+,14-,15+,16+,17+,18+,19+,20+,21-,22-,23-,24-/m0/s1
InChIKeyNGXOBULWHOWICY-VNFMDHTBSA-N
ChEBI Ontology
Outgoing Relation(s)
(2S,3R,4R,5R)-4-[(2S,3R,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-3,5-Dihydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexane-1,2,3,5,6-pentol (CHEBI:148611) is a oligosaccharide (CHEBI:50699)
Manual XrefsDatabases
G29110AMGlyTouCan