input word = C00005002

Metabolite InformationStructural formula
Name 3,5,7,4'-Tetrahydroxy-8-C-(3-methylsuccinoyl)flavone
3,5,7-Trihydroxy-2-(4-hydroxyphenyl)-alpha-methyl-gamma,4-dioxo-4H-1-benzopyran-8-butanoic acid
Formula C20H16O9
Mw 400.07943211
CAS RN 116368-96-8
C_ID C00005002 ,
InChIKey YTHNLQXRJHZHMM-UHFFFAOYNA-N
InChICode InChI=1S/C20H16O9/c1-8(20(27)28)6-11(22)14-12(23)7-13(24)15-16(25)17(26)18(29-19(14)15)9-2-4-10(21)5-3-9/h2-5,7-8,21,23-24,26H,6H2,1H3,(H,27,28)/t8-/m1/s1
SMILES c1(cc(c2c(c1C(=O)C[C@@H](C)C(=O)O)oc(c(c2=O)O)c1ccc(cc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLiliaceaeLilium candidum Ref.
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OrganismLilium candidum
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 181.Flavonols

Buckova,Phytochem.,27,(1988),1914