EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:62360 - propyl β-D-mannopyranosyl-(1→2)-β-D-mannopyranosyl-(1→2)-2-thio-β-D-mannopyranoside

ChEBI IDCHEBI:62360
ChEBI Namepropyl β-D-mannopyranosyl-(1→2)-β-D-mannopyranosyl-(1→2)-2-thio-β-D-mannopyranoside
Stars
ASCII Namepropyl beta-D-mannopyranosyl-(1->2)-beta-D-mannopyranosyl-(1->2)-2-thio-beta-D-mannopyranoside
DefinitionA glycoside that is the n-propyl glycoside of β-D-mannopyranosyl-(1→2)-β-D-mannopyranosyl-(1→2)-2-thio-β-D-mannopyranose.
Last Modified20 September 2012
SubmitterGareth Owen
DownloadsMolfile
FormulaC21H38O15S
Net Charge0
Average Mass562.587
Monoisotopic Mass562.19314
SMILESCCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O
InChIInChI=1S/C21H38O15S/c1-2-3-32-20-18(15(30)12(27)8(5-23)34-20)37-21-17(14(29)11(26)9(6-24)35-21)36-19-16(31)13(28)10(25)7(4-22)33-19/h7-31H,2-6H2,1H3/t7-,8-,9-,10-,11-,12-,13+,14+,15+,16+,17+,18+,19+,20-,21+/m1/s1
InChIKeyZELQEUPLYMBMBB-CRBPVCTJSA-N
ChEBI Ontology
Outgoing Relation(s)
propyl β-D-mannopyranosyl-(1→2)-β-D-mannopyranosyl-(1→2)-2-thio-β-D-mannopyranoside (CHEBI:62360) is a S-glycosyl compound (CHEBI:35275)
propyl β-D-mannopyranosyl-(1→2)-β-D-mannopyranosyl-(1→2)-2-thio-β-D-mannopyranoside (CHEBI:62360) is a glycoside (CHEBI:24400)
IUPAC Name 
propyl β-D-mannopyranosyl-(1→2)-β-D-mannopyranosyl-(1→2)-2-thio-β-D-mannopyranoside
Synonyms  Source
propyl β-D-mannopyranosyl-(1→2)-1-thio-β-D-mannopyranosyl-(1→2)-2-deoxy-2-thio-β-D-mannopyranosideChEBI
propyl (β-D-mannopyranosyl)-(1→2)-β-D-mannopyranosyl-(1→2)-2-deoxy-2-thio-β-D-mannopyranosideChEBI
Registry NumbersSources
Reaxys:19117345Reaxys
Citations