input word = C00046042

Metabolite InformationStructural formula
Name Isoaquiledine
(+)-Isoaquiledine
Formula C20H20N2O5
Mw 368.13722176
CAS RN 321408-08-6
C_ID C00046042 ,
InChIKey OPODLFBNKXTLEX-ZHNSNBKZNA-N
InChICode InChI=1S/C20H20N2O5/c23-13-9-14(24)18-15(25)10-16(11-5-2-1-3-6-11)27-19(18)17(13)12-7-4-8-21-20(26)22-12/h1-3,5-6,9,12,16,23-24H,4,7-8,10H2,(H2,21,22,26)/t12-,16+/m1/s1
SMILES O=C1NCCCC(c2c(O)cc(O)c3c2O[C@H](c2ccccc2)CC3=O)N1
Start Substs in Alk. Biosynthesis (Prediction) Anthranilate L-Lys L-Asp
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeAquilegia ecalcarata Ref.
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