input word = C00019191

Metabolite InformationStructural formula
Name Andinermal A
3-Carboxyaldehyde-4,3'-dihydroxy-6,2',4'-trimethoxy-2-arylbenzofuran
Formula C18H16O7
Mw 344.08960287
CAS RN 399023-88-2
C_ID C00019191 ,
InChIKey XDUYDNPZEINTJY-UHFFFAOYSA-N
InChICode InChI=1S/C18H16O7/c1-22-9-6-12(20)15-11(8-19)17(25-14(15)7-9)10-4-5-13(23-2)16(21)18(10)24-3/h4-8,20-21H,1-3H3
SMILES COc1cc(O)c2c(C=O)c(-c3ccc(OC)c(O)c3OC)oc2c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeAndira inermis Ref.
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OrganismAndira inermis
ReferenceKraft,Phytochem.,58,(2001),769