input word = C00013771

Metabolite InformationStructural formula
Name Kaempferol 3-(2''-(Z)-p-coumaroylglucoside)
5,7-Dihydroxy-2-(4-hydroxyphenyl)-3-[[2-O-[(2Z)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranosyl]oxy]-4H-1-benzopyran-4-one
Formula C30H26O13
Mw 594.13734092
CAS RN 189098-16-6
C_ID C00013771 ,
InChIKey IKONEAPXVKTZFF-KONXJHSQNA-N
InChICode InChI=1S/C30H26O13/c31-13-21-24(37)26(39)29(42-22(36)10-3-14-1-6-16(32)7-2-14)30(41-21)43-28-25(38)23-19(35)11-18(34)12-20(23)40-27(28)15-4-8-17(33)9-5-15/h1-12,21,24,26,29-35,37,39H,13H2/b10-3-/t21-,24+,26-,29-,30-/m0/s1
SMILES c1c(ccc(c1)O)c1oc2c(c(=O)c1O[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)OC(=O)/C=C\c1ccc(cc1)O)c(cc(c2)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeEryngium campestre Ref.
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