input word = C00019869

Metabolite InformationStructural formula
Name Fernolin
Formula C22H20O7
Mw 396.12090299
CAS RN 122537-46-6
C_ID C00019869 ,
InChIKey BSOQPQBWWASEBU-WUXMJOGZNA-N
InChICode InChI=1S/C22H20O7/c1-12(10-14-11-13(2)22(24)28-14)6-8-27-21-19-16(7-9-26-19)18(25-3)15-4-5-17(23)29-20(15)21/h4-7,9,11,14H,8,10H2,1-3H3/b12-6+/t14-/m1/s1
SMILES COc1c2ccoc2c(OC/C=C(C)CC2C=C(C)C(=O)O2)c2oc(=O)ccc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMoraceaeDorstenia brasiliensis Ref.
PlantaeRutaceaeFeronia limonia Ref.
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