input word = C00053626

Metabolite InformationStructural formula
Name Pandalactonine
Formula C18H21NO5
Mw 331.14197279
CAS RN 1814904-62-5
C_ID C00053626
InChIKey OPWFAJDMOBORGS-JHQAQSOUSA-N
InChICode InChI=1S/C18H21NO5/c1-11-9-13(22-16(11)20)5-3-7-15-19-8-4-6-14(19)18(23-15)10-12(2)17(21)24-18/h5,9-10,14-15H,3-4,6-8H2,1-2H3/b13-5-/t14-,15-,18+/m1/s1
SMILES O=C(O/1)C(C)=CC1=CCC[C@H]2O[C@@]3(OC(C(C)=C3)=O)[C@]4([H])N2CCC4
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePandanaceaePandanus amaryllifolius Ref.
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