EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:167920 - Phenethyl rutinoside

ChEBI IDCHEBI:167920
ChEBI NamePhenethyl rutinoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H30O10
Net Charge0
Average Mass430.450
Monoisotopic Mass430.18390
SMILESCC1OC(OCC2OC(OCCc3ccccc3)C(O)C(O)C2O)C(O)C(O)C1O
InChIInChI=1S/C20H30O10/c1-10-13(21)15(23)17(25)20(29-10)28-9-12-14(22)16(24)18(26)19(30-12)27-8-7-11-5-3-2-4-6-11/h2-6,10,12-26H,7-9H2,1H3
InChIKeyOKUGUNDXBGUFPA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Phenethyl rutinoside (CHEBI:167920) is a glycoside (CHEBI:24400)
IUPAC Name 
2-methyl-6-[[3,4,5-trihydroxy-6-(2-phenylethoxy)oxan-2-yl]methoxy]oxane-3,4,5-triol
Manual XrefsDatabases
HMDB0032622HMDB