input word = C00031245

Metabolite InformationStructural formula
Name Rubiawallin A
Formula C16H12O5
Mw 284.06847349
CAS RN 672903-80-9
C_ID C00031245 ,
InChIKey BPNMEZKFWZNCLT-UHFFFAOYSA-N
InChICode InChI=1S/C16H12O5/c1-20-8-3-4-9-11(7-8)14(17)10-5-6-12(21-2)16(19)13(10)15(9)18/h3-7,19H,1-2H3
SMILES c12c(C(=O)c3c(C1=O)ccc(c3O)OC)ccc(c2)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeRubia wallichiana DECNE Ref.
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