input word = C00056331

Metabolite InformationStructural formula
Name 2-(2-Hydroxy-4-methoxyphenyl)-5,8-dimethoxy-3-propyl-4(1H)-quinolinone
Formula C21H23NO5
Mw 369.15762285
CAS RN 1010070-86-6
C_ID C00056331
InChIKey KRDLFYZITUNBOK-UHFFFAOYSA-N
InChICode InChI=1S/C21H23NO5/c1-5-6-14-19(13-8-7-12(25-2)11-15(13)23)22-20-17(27-4)10-9-16(26-3)18(20)21(14)24/h7-11,23H,5-6H2,1-4H3,(H,22,24)
SMILES CCCc1c(-c2ccc(OC)cc2O)[nH]c2c(OC)ccc(OC)c2c1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCasimiroa edulis Ref.
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OrganismCasimiroa edulis
ReferenceAwaad, A.S. et al., Chem. Nat. Compd. (Engl. Transl.), 2007, 43, 576-580 (isol, pmr, cmr)