input word = C00004481

Metabolite InformationStructural formula
Name 5,6,7-Trihydroxyflavone 7-(6''-malonylglucoside)
Formula C24H22O13
Mw 518.10604079
CAS RN
C_ID C00004481 ,
InChIKey NLRUTPIOMCJQKC-GVCLXSOTNA-N
InChICode InChI=1S/C24H22O13/c25-11-6-12(10-4-2-1-3-5-10)35-13-7-14(19(29)21(31)18(11)13)36-24-23(33)22(32)20(30)15(37-24)9-34-17(28)8-16(26)27/h1-7,15,20,22-24,29-33H,8-9H2,(H,26,27)/t15-,20-,22+,23+,24-/m1/s1
SMILES c1(c(c(c2c(c1)oc(cc2=O)c1ccccc1)O)O)O[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)COC(=O)CC(=O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCactaceaeCephalocereus senilis Ref.
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