EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:178403 - Melibiulose

ChEBI IDCHEBI:178403
ChEBI NameMelibiulose
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H22O11
Net Charge0
Average Mass342.297
Monoisotopic Mass342.11621
SMILESOC[C@H]1O[C@H](OC[C@H]2OC(O)(CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O
InChIInChI=1S/C12H22O11/c13-1-4-6(15)8(17)9(18)11(22-4)21-2-5-7(16)10(19)12(20,3-14)23-5/h4-11,13-20H,1-3H2/t4-,5-,6+,7-,8+,9-,10+,11+,12?/m1/s1
InChIKeyPVXPPJIGRGXGCY-XIOYNQKVSA-N
ChEBI Ontology
Outgoing Relation(s)
Melibiulose (CHEBI:178403) is a glycoside (CHEBI:24400)
IUPAC Name 
(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-[[(2R,3S,4S)-3,4,5-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]methoxy]oxane-3,4,5-triol
Manual XrefsDatabases
9777340ChemSpider