input word = C00026821

Metabolite InformationStructural formula
Name Arundacine
Formula C25H30N4O2
Mw 418.23687623
CAS RN 492994-31-7
C_ID C00026821 ,
InChIKey LJMCWVGWPLWEQP-UHFFFAOYSA-N
InChICode InChI=1S/C25H30N4O2/c1-17(30)28(4)14-12-19-16-29(22-8-6-5-7-20(19)22)25-23(31)10-9-21-24(25)18(15-26-21)11-13-27(2)3/h5-10,15-16,26,31H,11-14H2,1-4H3
SMILES c1ccc2c(c1)n(cc2CCN(C(=O)C)C)c1c(ccc2c1c(c[nH]2)CCN(C)C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate IPP
Organism
Kingdom Family Species Reference
PlantaePoaceaeArundo donax L. Ref.
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OrganismArundo donax L.
ReferenceKhuzhaev,Chem.Nat.Prod.,38,(2002),280