input word = C00028694

Metabolite InformationStructural formula
Name NK 372135B
Formula C21H20N2O3
Mw 348.14739252
CAS RN 134923-09-4
C_ID C00028694 ,
InChIKey DAKHBQGGKOGUDC-YBEGLDIGNA-N
InChICode InChI=1S/C21H20N2O3/c1-24-19-7-5-17(6-8-19)18(14-23)11-16(13-22)10-15-4-9-20(25-2)21(12-15)26-3/h4-10,12,18H,11H2,1-3H3/b16-10-/t18-/m1/s1
SMILES COc1ccc(C(C#N)C/C(C#N)=C/c2ccc(OC)c(OC)c2)cc1
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
--Neosartoria fischeri Ref.
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