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CHEBI:9859 - umbelliferose

ChEBI IDCHEBI:9859
ChEBI Nameumbelliferose
Stars
Last Modified3 August 2014
DownloadsMolfile
FormulaC18H32O16
Net Charge0
Average Mass504.438
Monoisotopic Mass504.16903
SMILESOC[C@H]1O[C@H](O[C@H]2[C@@H](O[C@]3(CO)O[C@H](CO)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O
WURCSWURCS=2.0/2,3,2/[a2112h-1a_1-5][ha122h-2b_2-5]/1-2-1/a1-b2_a2-c1
InChIInChI=1S/C18H32O16/c19-1-5-8(23)11(26)13(28)16(30-5)32-14-12(27)9(24)6(2-20)31-17(14)34-18(4-22)15(29)10(25)7(3-21)33-18/h5-17,19-29H,1-4H2/t5-,6-,7-,8+,9+,10-,11+,12+,13-,14-,15+,16-,17-,18+/m1/s1
InChIKeyLNRUEZIDUKQGRH-YZUCMPLFSA-N
ChEBI Ontology
Outgoing Relation(s)
umbelliferose (CHEBI:9859) is a trisaccharide (CHEBI:27150)
IUPAC Name 
β-D-fructofuranosyl α-D-galactopyranosyl-(1→2)-α-D-glucopyranoside
Synonyms  Source
UmbelliferoseKEGG COMPOUND
α-D-Galp-(1→2)-α-D-Glcp-(1↔2)-β-D-FrufJCBN
Manual XrefsDatabases
C08251KEGG COMPOUND
C00001153KNApSAcK
Registry NumbersSources
Beilstein:1411190Beilstein
CAS:546-60-1KEGG COMPOUND