input word = C00005062

Metabolite InformationStructural formula
Name Melicophyllin
Formula C21H20O9
Mw 416.11073224
CAS RN 119968-22-8
C_ID C00005062 ,
InChIKey GEYGCJJAQJKPEH-UHFFFAOYSA-N
InChICode InChI=1S/C21H20O9/c1-23-11-7-6-10(8-12(11)24-2)15-18(26-4)14(22)13-16(25-3)20-21(29-9-28-20)19(27-5)17(13)30-15/h6-8H,9H2,1-5H3
SMILES c12c(c(c3c(c1OC)oc(c(c3=O)OC)c1ccc(c(c1)OC)OC)OC)OCO2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeMelicope triphylla Ref.
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