input word = C00052082

Metabolite InformationStructural formula
Name Lunasia II
(+)-Isobalfourodine
Formula C16H19NO4
Mw 289.1314081
CAS RN 478-38-6
C_ID C00052082
InChIKey MSDAMDHEPWLWJZ-GFCCVEGCSA-N
InChICode InChI=1S/C16H19NO4/c1-16(2)12(18)8-10-14(19)9-6-5-7-11(20-4)13(9)17(3)15(10)21-16/h5-7,12,18H,8H2,1-4H3/t12-/m1/s1
SMILES COc1cccc2c(=O)c3c(n(C)c12)OC(C)(C)[C@H](O)C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeEsenbeckia hieronimi Ref.
PlantaeRutaceaeLunasia amara Ref.
PlantaeRutaceaeOrixa japonica Ref.
--Balfourodendrom riedelianum Ref.
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OrganismLunasia amara
ReferenceNatural Products Vol.1 ISBN978-3-642-22143-9