C00004684 - Xanthium strumarium
C_ID C00004684
CAS RN 5188-73-8
Metabolite Axillarin;3,6-Dimethoxy-5,7,3',4'-tetrahydroxyflavone;Quercetagetin 3,6-dimethyl ether;2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3,6-dimethoxy-4H-1-benzopyran-4-one
Molecular Formula C17H14O8
Organism Xanthium strumarium
Kingdom Plantae
Family Asteraceae
Genus Xanthium
SMILES c1(c(c(c2c(c1)oc(c(c2=O)OC)c1ccc(c(c1)O)O)O)OC)O
InChI InChI=1S/C17H14O8/c1-23-16-10(20)6-11-12(13(16)21)14(22)17(24-2)15(25-11)7-3-4-8(18)9(19)5-7/h3-6,18-21H,1-2H3
InChIKey KIGVXRGRNLQNNI-UHFFFAOYSA-N
Reference Wollenweber,Z.Naturforsch.,52c,(1997),137
Structural formula image