input word = C00052337

Metabolite InformationStructural formula
Name Lunine
Formula C16H17NO4
Mw 287.11575804
CAS RN 518-60-5
C_ID C00052337
InChIKey PPSOAEAJQYYWFV-LBPRGKRZSA-N
InChICode InChI=1S/C16H17NO4/c1-8(2)12-6-10-14(18)9-4-5-11-15(20-7-19-11)13(9)17(3)16(10)21-12/h4-5,8,12H,6-7H2,1-3H3/t12-/m0/s1
SMILES CC(C)[C@@H]1Cc2c(n(C)c3c4c(ccc3c2=O)OCO4)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeLunasia amara Ref.
PlantaeRutaceaeLunasia quercifolia Ref.
PlantaeRutaceaePtelea trifoliata Ref.
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