input word = C00013774

Metabolite InformationStructural formula
Name Kaempferol 3-(5''-feruloylapioside)
[3S-[3alpha,3(E),4alpha,5beta]]-3-(4-Hydroxy-3-methoxyphenyl)-, [5-[[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-3-yl]oxy]tetrahydro-3,4-dihydroxy-3-furanyl]methyl ester 2-propenoic acid
Formula C30H26O13
Mw 594.13734092
CAS RN 185066-55-1
C_ID C00013774 ,
InChIKey JXONCIVNSCDGQY-VTNHYZDNNA-N
InChICode InChI=1S/C30H26O13/c1-39-21-10-15(2-8-19(21)33)3-9-23(35)40-13-30(38)14-41-29(28(30)37)43-27-25(36)24-20(34)11-18(32)12-22(24)42-26(27)16-4-6-17(31)7-5-16/h2-12,28-29,31-34,37-38H,13-14H2,1H3/b9-3+/t28-,29+,30+/m1/s1
SMILES c1c(ccc(c1)O)c1oc2c(c(=O)c1O[C@H]1[C@H]([C@](O)(COC(=O)/C=C/c3ccc(c(c3)OC)O)CO1)O)c(cc(c2)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDennstaedtiaceaePteridium aquilinum Ref.
zoom in