input word = C00005844

Metabolite InformationStructural formula
Name Kaempferol 3-(6''-malonylglucoside)
6''-Malonylastragalin
Formula C24H22O14
Mw 534.10095541
CAS RN 81149-02-2
C_ID C00005844 ,
InChIKey XEXCLTHHXIWUHO-ARDHPIDCNA-N
InChICode InChI=1S/C24H22O14/c25-10-3-1-9(2-4-10)22-23(19(32)17-12(27)5-11(26)6-13(17)36-22)38-24-21(34)20(33)18(31)14(37-24)8-35-16(30)7-15(28)29/h1-6,14,18,20-21,24-27,31,33-34H,7-8H2,(H,28,29)/t14-,18-,20-,21+,24+/m1/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@H]1[C@H]([C@@H]([C@@H]([C@H](O1)COC(=O)CC(=O)O)O)O)O)c1ccc(cc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAspleniaceaeCeterach officinarum Ref.
PlantaeEquisetaceaeEquisetum spp. Ref.
PlantaeFabaceaeCicer sp. Ref.
PlantaeRosaceaePyrus communis Ref.
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