CHEBI:62976 - cellopentaose

ChEBI IDCHEBI:62976
ChEBI Namecellopentaose
Stars
DefinitionA pentasaccharide comprised of five D-glucose residues connected by β(1→4) linkages.
Last Modified7 March 2019
DownloadsMolfile
FormulaC30H52O26
Net Charge0
Average Mass828.720
Monoisotopic Mass828.27468
SMILESOC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O[C@H]4[C@H](O)[C@@H](O)[C@H](O[C@H]5[C@H](O)[C@@H](O)C(O)O[C@@H]5CO)O[C@@H]4CO)O[C@@H]3CO)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O
WURCSWURCS=2.0/2,5,4/[a2122h-1x_1-5][a2122h-1b_1-5]/1-2-2-2-2/a4-b1_b4-c1_c4-d1_d4-e1
InChIInChI=1S/C30H52O26/c31-1-6-11(36)12(37)18(43)27(49-6)54-23-8(3-33)51-29(20(45)14(23)39)56-25-10(5-35)52-30(21(46)16(25)41)55-24-9(4-34)50-28(19(44)15(24)40)53-22-7(2-32)48-26(47)17(42)13(22)38/h6-47H,1-5H2/t6-,7-,8-,9-,10-,11-,12+,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26?,27+,28+,29+,30+/m1/s1
InChIKeyFTNIPWXXIGNQQF-XHCCAYEESA-N
ChEBI Ontology
Outgoing Relation(s)
cellopentaose (CHEBI:62976) is a pentasaccharide (CHEBI:35369)
Incoming Relation(s)
β-cellopentaose (CHEBI:49536) is a cellopentaose (CHEBI:62976)
IUPAC Name 
β-D-glucopyranosyl-(1→4)-β-D-glucopyranosyl-(1→4)-β-D-glucopyranosyl-(1→4)-β-D-glucopyranosyl-(1→4)-D-glucopyranose
Synonym  Source
β-D-Glcp-(1→4)-β-D-Glcp-(1→4)-β-D-Glcp-(1→4)-β-D-Glcp-(1→4)-D-GlcpJCBN
UniProt Name  Source
D-cellopentaoseUniProt
Manual XrefsDatabases
CPD-13237MetaCyc
G00546KEGG GLYCAN
Registry NumbersSources
Reaxys:1418065Reaxys
Citations