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CHEBI:6559 - lucumin

ChEBI IDCHEBI:6559
ChEBI Namelucumin
Stars
DefinitionA disaccharide derivative that is 6-O-β-D-xylopyranosyl-β-D-glucopyranose having an (R)-mandelonitrile group at the anomeric position.
Last Modified28 July 2014
DownloadsMolfile
FormulaC19H25NO10
Net Charge0
Average Mass427.406
Monoisotopic Mass427.14785
SMILESN#C[C@H](O[C@@H]1O[C@H](CO[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
InChIInChI=1S/C19H25NO10/c20-6-11(9-4-2-1-3-5-9)29-19-17(26)15(24)14(23)12(30-19)8-28-18-16(25)13(22)10(21)7-27-18/h1-5,10-19,21-26H,7-8H2/t10-,11+,12-,13+,14-,15+,16-,17-,18+,19-/m1/s1
InChIKeyYYYCJNDALLBNEG-DZMQVIFMSA-N
ChEBI Ontology
Outgoing Relation(s)
lucumin (CHEBI:6559) has functional parent (R)-mandelonitrile (CHEBI:18450)
lucumin (CHEBI:6559) is a disaccharide derivative (CHEBI:63353)
lucumin (CHEBI:6559) is a glycoside (CHEBI:24400)
IUPAC Name 
(2R)-phenyl{[6-O-(β-D-xylopyranosyl)-β-D-glucopyranosyl]oxy}acetonitrile
Synonyms  Source
LucuminKEGG COMPOUND
LucumineChemIDplus
Manual XrefsDatabases
C08335KEGG COMPOUND
C00001449KNApSAcK
Registry NumbersSources
Beilstein:63928Beilstein
CAS:1392-28-5KEGG COMPOUND
CAS:1392-28-5ChemIDplus