input word = C00052297

Metabolite InformationStructural formula
Name Grandisine III
Formula C15H13NO5
Mw 287.07937253
CAS RN 145940-35-8
C_ID C00052297
InChIKey QNXGBYOUHGRJCI-UHFFFAOYSA-N
InChICode InChI=1S/C15H13NO5/c1-16-9-5-7(17)6-11(19)12(9)14(20)8-3-4-10(18)15(21-2)13(8)16/h3-6,17-19H,1-2H3
SMILES O=C1C2=CC=C(O)C(OC)=C2N(C)C3=CC(O)=CC(O)=C13
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus paradisi Ref.
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