input word = C00052296

Metabolite InformationStructural formula
Name Grandisine II
Formula C16H15NO5
Mw 301.0950226
CAS RN 87959-99-7
C_ID C00052296
InChIKey RPXHTTDVHFFAHL-UHFFFAOYSA-N
InChICode InChI=1S/C16H15NO5/c1-17-10-6-8(18)7-11(19)13(10)15(20)9-4-5-12(21-2)16(22-3)14(9)17/h4-7,18-19H,1-3H3
SMILES COc1ccc2c(=O)c3c(O)cc(O)cc3n(C)c2c1OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus funadoka Ref.
PlantaeRutaceaeCitrus grandis Ref.
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