input word = C00009788

Metabolite InformationStructural formula
Name Robustic acid methyl ether
Methyl robustate
O-Methylrobustic acid
Formula C23H22O6
Mw 394.14163844
CAS RN 5307-60-8
C_ID C00009788 ,
InChIKey UPHWJAWTGRBPAJ-UHFFFAOYSA-N
InChICode InChI=1S/C23H22O6/c1-23(2)11-10-15-16(29-23)12-17-19(20(15)26-4)21(27-5)18(22(24)28-17)13-6-8-14(25-3)9-7-13/h6-12H,1-5H3
SMILES c12c(c(c3c(c1)oc(=O)c(c3OC)c1ccc(cc1)OC)OC)C=CC(O2)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeDeguelia hatschbachii Ref.
PlantaeFabaceaeDerris robusta Ref.
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