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CHEBI:9369 - swertiajaponin

Default Structure
ChEBI IDCHEBI:9369
ChEBI Nameswertiajaponin
Stars
DefinitionA flavone C-glycoside that is isoorientin in which the hydroxy group at position 7 is replaced by a methoxy group.
Last Modified28 May 2026
DownloadsMolfile
FormulaC22H22O11
Net Charge0
Average Mass462.407
Monoisotopic Mass462.11621
SMILESCOc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3/t15-,18-,20+,21-,22+/m1/s1
InChIKeyDLVLXOYLQKCAME-DGHBBABESA-N
Species of MetaboliteComponentSourceComments
Cymbopogon citratus (ncbitaxon:66014) - PubMed (19924037)
Swertia japonica (ncbitaxon:137129) - PubMed (5583807)
Zantedeschia aethiopica (ncbitaxon:69721) - PubMed (25924520)
ChEBI Ontology
Outgoing Relation(s)
swertiajaponin (CHEBI:9369) has functional parent isoorientin (CHEBI:17965)
swertiajaponin (CHEBI:9369) is a flavone C-glycoside (CHEBI:83280)
swertiajaponin (CHEBI:9369) is a monomethoxyflavone (CHEBI:25401)
swertiajaponin (CHEBI:9369) is a trihydroxyflavone (CHEBI:27116)
IUPAC Name 
(1S)-1,5-anhydro-1-[2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxy-4-oxo-4H-1-benzopyran-6-yl]-D-glucitol
Synonyms  Source
6-C-β-D-glucopyranosyl-7-O-methylluteolinChEBI
6-β-D-glucopyranosyl-3',4',5-trihydroxy-7-methoxyflavoneLIPID MAPS
7-O-methylisoorientinChEBI
LeucanthosideLIPID MAPS
Manual XrefsDatabases
C00001102KNApSAcK
C10187KEGG COMPOUND
HMDB0030569HMDB
LMPK12111030LIPID MAPS
Registry NumbersSources
Reaxys:1360155Reaxys
CAS:6980-25-2ChemIDplus
CAS:6980-25-2KEGG COMPOUND
Citations