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CHEBI:176124 - Loquatoside

ChEBI IDCHEBI:176124
ChEBI NameLoquatoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H22O11
Net Charge0
Average Mass438.385
Monoisotopic Mass438.11621
SMILESOc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O[C@@H]1OC[C@H](O)[C@H](O)[C@H]1O)C2O
InChIInChI=1S/C20H22O11/c21-8-4-11(24)14-13(5-8)30-18(7-1-2-9(22)10(23)3-7)19(16(14)27)31-20-17(28)15(26)12(25)6-29-20/h1-5,12,15-28H,6H2/t12-,15-,16?,17+,18?,19?,20-/m0/s1
InChIKeyYISJRMFABYGQSX-NUVGQASKSA-N
ChEBI Ontology
Outgoing Relation(s)
Loquatoside (CHEBI:176124) is a flavonoids (CHEBI:72544)
Loquatoside (CHEBI:176124) is a glycoside (CHEBI:24400)
IUPAC Name 
2-(3,4-dihydroxyphenyl)-3-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-3,4-dihydro-2H-chromene-4,5,7-triol
Manual XrefsDatabases
137611ChemSpider
Registry NumbersSources
CAS:74046-15-4ChemIDplus