CHEBI:9369 - swertiajaponin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name swertiajaponin
ChEBI ID CHEBI:9369
Definition A flavone C-glycoside that is isoorientin in which the hydroxy group at position 7 is replaced by a methoxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C22H24O11
Net Charge 0
Average Mass 464.41940
Monoisotopic Mass 464.13186
InChI InChI=1S/C22H24O11/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/h2-6,14-16,18,20-25,27-30H,7H2,1H3/t14?,15-,16?,18-,20+,21-,22+/m1/s1
InChIKey UMWNGGYPGAHOPP-IBKWXVHQSA-N
SMILES COC1=CC2OC(=CC(=O)C2C(O)=C1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccc(O)c(O)c1
Metabolite of Species Details
Swertia japonica (NCBI:txid137129) See: PubMed
Cymbopogon citratus (NCBI:txid66014) See: PubMed
Zantedeschia aethiopica (NCBI:txid69721) See: PubMed
ChEBI Ontology
Outgoing 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-4a,8a-dihydro-4H-1-benzopyran-6-yl]-D-glucitol
Synonyms Sources
6-C-β-D-glucopyranosyl-7-O-methylluteolin ChEBI
7-O-methylisoorientin ChEBI
Leucanthoside LIPID MAPS
Manual Xrefs Databases
C00001102 KNApSAcK
C10187 KEGG COMPOUND
HMDB0030569 HMDB
LMPK12111030 LIPID MAPS
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Registry Numbers Types Sources
1360155 Reaxys Registry Number Reaxys
6980-25-2 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
19924037 PubMed citation Europe PMC
23413560 PubMed citation Europe PMC
25924520 PubMed citation Europe PMC
5583807 PubMed citation Europe PMC
Last Modified
02 June 2015