input word = C00053039

Metabolite InformationStructural formula
Name Epoxybergamottin
Formula C21H22O5
Mw 354.14672381
CAS RN 206978-14-5
C_ID C00053039
InChIKey OOKSPQLCQUBEKU-MDWZMJQESA-N
InChICode InChI=1S/C21H22O5/c1-13(4-6-18-21(2,3)26-18)8-10-24-20-14-5-7-19(22)25-17(14)12-16-15(20)9-11-23-16/h5,7-9,11-12,18H,4,6,10H2,1-3H3/b13-8+
SMILES O=C1C=CC(C(OC/C=C(C)/CCC2OC2(C)C)=C(C=CO3)C3=C4)=C4O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus aurantium Ref.
PlantaeRutaceaeCitrus maxima Ref.
PlantaeRutaceaeCitrus paradisi Ref.
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