input word = C00052253

Metabolite InformationStructural formula
Name Cuspanine
Formula C17H17NO6
Mw 331.10558728
CAS RN 143438-94-2
C_ID C00052253
InChIKey AJRHMDUHBMQVJL-UHFFFAOYSA-N
InChICode InChI=1S/C17H17NO6/c1-21-10-6-5-8-13(16(10)23-3)18-9-7-11(22-2)17(24-4)15(20)12(9)14(8)19/h5-7,20H,1-4H3,(H,18,19)
SMILES COc1cc2[nH]c3c(OC)c(OC)ccc3c(=O)c2c(O)c1OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Angostura paniculata Ref.
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OrganismAngostura paniculata
ReferenceNatural Products Vol.1 ISBN978-3-642-22143-9