CHEBI:27679 - betagarin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name betagarin
ChEBI ID CHEBI:27679
Definition An extended flavonoid that is 6,7-methylenedioxyflavanone substituted by methoxy groups at positions 5 and 2' respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:3072, CHEBI:22857
Supplier Information
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Formula C18H16O6
Net Charge 0
Average Mass 328.31600
Monoisotopic Mass 328.09469
InChI InChI=1S/C18H16O6/c1-20-12-6-4-3-5-10(12)13-7-11(19)16-14(24-13)8-15-17(18(16)21-2)23-9-22-15/h3-6,8,13H,7,9H2,1-2H3/t13-/m0/s1
InChIKey IHPVFYLOGNNZLA-ZDUSSCGKSA-N
SMILES COc1ccccc1[C@@H]1CC(=O)c2c(O1)cc1OCOc1c2OC
ChEBI Ontology
Outgoing betagarin (CHEBI:27679) is a dimethoxyflavanone (CHEBI:38743)
betagarin (CHEBI:27679) is a extended flavonoid (CHEBI:71037)
betagarin (CHEBI:27679) is a organic heterotricyclic compound (CHEBI:26979)
IUPAC Name
(6S)-9-methoxy-6-(2-methoxyphenyl)-6,7-dihydro-8H-[1,3]dioxolo[4,5-g]chromen-8-one
Synonyms Sources
5,2'-Dimethoxy-6,7-methylenedioxyflavanone KEGG COMPOUND
Betagarin KEGG COMPOUND
Manual Xrefs Databases
C00000942 KNApSAcK
C09479 KEGG COMPOUND
HMDB0030727 HMDB
LMPK12140599 LIPID MAPS
View more database links
Registry Number Type Source
60132-69-6 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014