input word = C00005648

Metabolite InformationStructural formula
Name Patuletin 3,7-diglucoside
Quercetagetin 6-methyl ether 3,7-diglucoside
2-(3,4-Dihydroxyphenyl)-3,7-bis(beta-D-glucopyranosyloxy)-5-hydroxy-6-methoxy-4H-1-benzopyran-4-one
Formula C28H32O18
Mw 656.15886422
CAS RN 33530-68-6
C_ID C00005648 ,
InChIKey LFEVAVXNEAXTBG-LCQDUQQVNA-N
InChICode InChI=1S/C28H32O18/c1-41-25-12(43-27-22(39)20(37)16(33)13(6-29)44-27)5-11-15(18(25)35)19(36)26(24(42-11)8-2-3-9(31)10(32)4-8)46-28-23(40)21(38)17(34)14(7-30)45-28/h2-5,13-14,16-17,20-23,27-35,37-40H,6-7H2,1H3/t13-,14-,16-,17-,20+,21+,22-,23-,27-,28+/m1/s1
SMILES c1(c(c(c2c(c1)oc(c(c2=O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)c1ccc(c(c1)O)O)O)OC)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArnica montana Ref.
PlantaeAsteraceaeLasthenia conjugens Ref.
PlantaeAsteraceaeLasthenia fremontii Ref.
zoom in



OrganismArnica montana
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 297.Flavonol O-glycosides

Saleh,Phytochem.,10,(1971),611

Merfort,Planta Med.,58,(1992),355