C00003845 - Tanacetum vulgare
C_ID C00003845
CAS RN 22368-21-4
Metabolite Eupatilin;2-(3,4-Dimethoxyphenyl)-5,7-dihydroxy-6-methoxy-4H-1-benzopyran-4-one
Molecular Formula C18H16O7
Organism Tanacetum vulgare
Kingdom Plantae
Family Asteraceae
Genus Tanacetum
SMILES c1(c(c(c2c(c1)oc(cc2=O)c1ccc(c(c1)OC)OC)O)OC)O
InChI InChI=1S/C18H16O7/c1-22-12-5-4-9(6-14(12)23-2)13-7-10(19)16-15(25-13)8-11(20)18(24-3)17(16)21/h4-8,20-21H,1-3H3
InChIKey DRRWBCNQOKKKOL-UHFFFAOYSA-N
Reference Kupchan,S.M.et al.,Tetrahedron,25,(1969),1603-1615
Structural formula image