input word = C00052242

Metabolite InformationStructural formula
Name Citracridone II
Formula C21H21NO5
Mw 367.14197279
CAS RN 81525-62-4
C_ID C00052242
InChIKey OBCBNXMEAJGWOD-UHFFFAOYSA-N
InChICode InChI=1S/C21H21NO5/c1-21(2)9-8-11-15(27-21)10-13(23)16-17(11)22(3)18-12(19(16)24)6-7-14(25-4)20(18)26-5/h6-10,23H,1-5H3
SMILES COc1ccc2c(=O)c3c(O)cc4c(c3n(C)c2c1OC)C=CC(C)(C)O4
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus decumana Ref.
PlantaeRutaceaeCitrus depressa Ref.
PlantaeRutaceaeCitrus grandis Ref.
PlantaeRutaceaeCitrus hybrid ''Yalaha'' Ref.
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OrganismCitrus depressa
ReferenceNatural Products Vol.1 ISBN978-3-642-22143-9