input word = C00052245

Metabolite InformationStructural formula
Name Citropone A
Formula C22H19NO6
Mw 393.12123735
CAS RN 98496-33-4
C_ID C00052245
InChIKey JNCCPKHIJPEQFS-UHFFFAOYSA-N
InChICode InChI=1S/C22H19NO6/c1-10(24)16-13(25)6-5-12-19(21(16)28)23(4)18-11-7-8-22(2,3)29-15(11)9-14(26)17(18)20(12)27/h5-9,25-26H,1-4H3
SMILES O=C1C2=C(O)C=C(OC(C)(C)C=C3)C3=C2N(C)C4=C1C=CC(O)=C(C(C)=O)C4=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus grandis Ref.
PlantaeRutaceaeCitrus natsudaidai Ref.
PlantaeRutaceaeCitrus nobilis Ref.
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