input word = C00056401

Metabolite InformationStructural formula
Name N-Jasmonoyltyrosine
Formula C21H27NO5
Mw 373.18892298
CAS RN 105801-18-1
C_ID C00056401
InChIKey SLWSWKGGZQCLDU-WHHQMRSUSA-N
InChICode InChI=1S/C21H27NO5/c1-2-3-4-5-17-15(8-11-19(17)24)13-20(25)22-18(21(26)27)12-14-6-9-16(23)10-7-14/h3-4,6-7,9-10,15,17-18,23H,2,5,8,11-13H2,1H3,(H,22,25)(H,26,27)/b4-3-/t15-,17-,18+/m1/s1
SMILES OC([C@H](CC1=CC=C(O)C=C1)NC(C[C@@H]2[C@@H](C/C=CCC)C(CC2)=O)=O)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeVicia faba Ref.
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