input word = C00013981

Metabolite InformationStructural formula
Name Larycitrin 3-(4''-malonylrhamnoside)
Myricetin 3' methyl ether 3-(4''-malonylrhamnoside)
Formula C25H24O15
Mw 564.1115201
CAS RN
C_ID C00013981 ,
InChIKey CLJHAXXQLXXEAX-LRSYRYGUNA-N
InChICode InChI=1S/C25H24O15/c1-8-22(39-16(31)7-15(29)30)20(34)21(35)25(37-8)40-24-19(33)17-11(27)5-10(26)6-13(17)38-23(24)9-3-12(28)18(32)14(4-9)36-2/h3-6,8,20-22,25-28,32,34-35H,7H2,1-2H3,(H,29,30)/t8-,20-,21-,22-,25-/m0/s1
SMILES COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2OC(C)[C@H](OC(=O)CC(=O)O)C(O)[C@@H]2O)cc(O)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeGrossulariaceaeRibes alpinum Ref.
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