EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:28191 - 6-α-maltosylglucose

ChEBI IDCHEBI:28191
ChEBI Name6-α-maltosylglucose
Stars
ASCII Name6-alpha-maltosylglucose
DefinitionA glucotriose consisting of two α-D-glucopyranose residues and a D-glucopyranose residue joined in sequence by (1→4) and (1→6) glycosidic bonds.
Secondary ChEBI IDsCHEBI:2238, CHEBI:20696
Last Modified28 October 2020
DownloadsMolfile
FormulaC18H32O16
Net Charge0
Average Mass504.438
Monoisotopic Mass504.16903
SMILESOC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](OC[C@H]3OC(O)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O
WURCSWURCS=2.0/2,3,2/[a2122h-1x_1-5][a2122h-1a_1-5]/1-2-2/a6-b1_b4-c1
InChIInChI=1S/C18H32O16/c19-1-4-7(21)10(24)13(27)18(32-4)34-15-5(2-20)33-17(14(28)11(15)25)30-3-6-8(22)9(23)12(26)16(29)31-6/h4-29H,1-3H2/t4-,5-,6-,7-,8-,9+,10+,11-,12-,13-,14-,15-,16?,17+,18-/m1/s1
InChIKeyQSESWLKFTMBIPZ-UCFFOQEWSA-N
ChEBI Ontology
Outgoing Relation(s)
6-α-maltosylglucose (CHEBI:28191) is a glucotriose (CHEBI:146180)
IUPAC Names 
α-D-glucopyranosyl-(1→4)-α-D-glucopyranosyl-(1→6)-D-glucopyranose
Glc(a1-4)Glc(a1-6)Glc
Synonyms  Source
α-D-gluco-hexopyranosyl-(1→4)-α-D-gluco-hexopyranosyl-(1→6)-D-gluco-hexopyranoseIUPAC
(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-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2,3,4,5-tetrolIUPAC
(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-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxymethyl]oxane-2,3,4,5-tetrolIUPAC
Manual XrefsDatabases
HMDB0039707HMDB
C03367KEGG COMPOUND
G07348OGGlyTouCan
G00389KEGG GLYCAN
G07348OGGlyGen