input word = C00004450

Metabolite InformationStructural formula
Name 5-Hydroxy-7,8,2',3'-tetramethoxyflavone 5-glucoside
Formula C25H28O12
Mw 520.15807636
CAS RN 113963-40-9
C_ID C00004450 ,
InChIKey PPQXLPYIRAWACL-WIWROYAANA-N
InChICode InChI=1S/C25H28O12/c1-31-13-7-5-6-11(22(13)33-3)14-8-12(27)18-15(9-16(32-2)23(34-4)24(18)35-14)36-25-21(30)20(29)19(28)17(10-26)37-25/h5-9,17,19-21,25-26,28-30H,10H2,1-4H3/t17-,19-,20+,21-,25-/m1/s1
SMILES COc1cccc(-c2cc(=O)c3c(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)cc(OC)c(OC)c3o2)c1OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeAndrographis paniculata Ref.
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