input word = C00007939

Metabolite InformationStructural formula
Name Calomelanone
Formula C17H18O5
Mw 302.11542369
CAS RN 35241-54-4
C_ID C00007939 ,
InChIKey VVDZZNWYISOIDK-UHFFFAOYSA-N
InChICode InChI=1S/C17H18O5/c1-21-12-6-3-11(4-7-12)5-8-14(18)17-15(19)9-13(22-2)10-16(17)20/h3-4,6-7,9-10,19-20H,5,8H2,1-2H3
SMILES c1(cc(c(c(c1)O)C(=O)CCc1ccc(cc1)OC)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePteridaceaeNotholaena sulphurea Ref.
PlantaePteridaceaePityrogramma calomelanos Ref.
PlantaePteridaceaePityrogramma chrysophylla Ref.
PlantaePteridaceaePityrogramma tartarea Ref.
PlantaeSalicaceaePopulus trichocarpa Ref.
PlantaeSalicaceaePopulus x jackii Ref.
zoom in



OrganismPityrogramma tartarea
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 115,Chalcones,dihydrochalcones and aurones

Nilsson,Acata Chem.Scand.,15,(1961),154

Star,Phytochem.,10,(1971),2817