input word = C00005048

Metabolite InformationStructural formula
Name Isokanugin
3,5,7-Trimethoxy-3',4'-methylenedioxyflavone
2-(1,3-Benzodioxol-5-yl)-3,5,7-trimethoxy-4H-1-benzopyran-4-one
Formula C19H16O7
Mw 356.08960287
CAS RN 4494-27-3
C_ID C00005048 ,
InChIKey GDROEPRRAVOAOE-UHFFFAOYSA-N
InChICode InChI=1S/C19H16O7/c1-21-11-7-14(22-2)16-15(8-11)26-18(19(23-3)17(16)20)10-4-5-12-13(6-10)25-9-24-12/h4-8H,9H2,1-3H3
SMILES COc1cc(OC)c2c(=O)c(OC)c(-c3ccc4c(c3)OCO4)oc2c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeMelicope simplex Ref.
PlantaeRutaceaeMelicope subunifoliolata (Stapf) T.G.Hartley Ref.
PlantaeRutaceaeMelicope ternata Ref.
PlantaeRutaceaeMelicope triphylla Ref.
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OrganismMelicope triphylla
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 181.Flavonols

Higa,Yakugaku Zasshi,107,(1987),954